Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | KCNA1 | Q09470 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | BBOX1 | O75936 | 4/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.33 |
| ▸ | CA4 | P22748 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MGAM | O43451 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | SI | P14410 | 2/20 | 0.32 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Tetrylammonium SCHEMBL29047699 | 0.83 | TSHR (0.44) | TSHRNFKB1KCNA1KDM4EPMP22 | |
| SCHEMBL10410042 | 0.83 | BBOX1 (0.38) | TSHRNFKB1BBOX1FFAR3HDAC3 | |
| Tetrylammonium SCHEMBL15632811 | 0.82 | TSHR (0.38) | TSHRNFKB1KCNA1KDM4EPMP22 | |
| Tetrylammonium SCHEMBL168440 | 0.82 | TSHR (0.57) | TSHRNFKB1KCNA1KDM4EPMP22 | |
| SCHEMBL10641701 | 0.81 | BBOX1 (0.46) | TSHRNFKB1BBOX1FFAR3HDAC3 | |
| SCHEMBL2229655 | 0.81 | BBOX1 (0.46) | TSHRNFKB1BBOX1FFAR3HDAC3 | |
| Tetrylammonium SCHEMBL4773294 | 0.80 | MGAM (0.42) | TSHRNFKB1KCNA1KDM4EPMP22 | |
| Tetrylammonium SCHEMBL4772080 | 0.80 | CA4 (0.59) | TSHRNFKB1KCNA1KDM4EPMP22 | |
| Tetrylammonium SCHEMBL9004237 | 0.80 | TSHR (0.47) | TSHRNFKB1KCNA1KDM4EPMP22 | |
| Tetrylammonium SCHEMBL18144308 | 0.79 | TSHR (0.53) | TSHRNFKB1KCNA1KDM4EPMP22 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2977395-A1 | HIGHLY REACTIVE, POLYURETHANE COMPOSITIONS CONTAINING URETDIONE GROUPS WHICH CONTAIN THE CARBONATE SALTS | Evonik Degussa GmbH (DE) | 2016-01-27 | — | — | EP | claimed |
| US-20160017179-A1 | HIGH-REACTIVITY POLYURETHANE COMPOSITIONS CONTAINING URETDIONE GROUPS AND COMPRISING CARBONATE SALTS | EVONIK DEGUSSA GMBH (DE) | 2016-01-21 | — | — | US | claimed |
| EP-2977395-A1 | HIGHLY REACTIVE, POLYURETHANE COMPOSITIONS CONTAINING URETDIONE GROUPS WHICH CONTAIN THE CARBONATE SALTS | Evonik Degussa GmbH (DE) | 2016-01-27 | — | — | EP | disclosed |
| US-20160017179-A1 | HIGH-REACTIVITY POLYURETHANE COMPOSITIONS CONTAINING URETDIONE GROUPS AND COMPRISING CARBONATE SALTS | EVONIK DEGUSSA GMBH (DE) | 2016-01-21 | — | — | US | disclosed |
| EP-0999206-B1 | Process for producing alpha cyano acetic acid esters | BASF AG (DE) | 2002-09-18 | — | — | EP | disclosed |
| US-6130347-A | REACTING MONOCHLOROACETIC ESTER WITH HYDROGEN CYANIDE IN BASE PRESENCE; CYANATION | BASF AKTIENGESELLSCHAFT (DE) | 2000-10-10 | — | — | US | disclosed |
| EP-0999206-A1 | Process for producing alpha cyano acetic acid esters | BASF AKTIENGESELLSCHAFT (DE) | 2000-05-10 | — | — | EP | disclosed |
| EP-0671384-B1 | Process for the preparation of 3-cyano-3,5,5,-trimethyl-cyclohexanone | BASF AG (DE) | 1999-11-03 | — | — | EP | disclosed |
| US-5516928-A | REACTION OF ISOPHORONE AND HYDROGEN CYANIDE USING QUATERNARY AMMONIUM CATALYST | BASF AKTIENGESELLSCHAFT (DE) | 1996-05-14 | — | — | US | disclosed |
| EP-0671384-A1 | Process for the preparation of 3-cyano-3,5,5,-trimethyl-cyclohexanone | BASF AKTIENGESELLSCHAFT (DE) | 1995-09-13 | — | — | EP | disclosed |
| US-4776929-A | Process for production of quaternary ammonium hydroxides | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1988-10-11 | — | — | US | disclosed |