Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | HPGD | P15428 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | CES2 | O00748 | 5/20 | 0.39 |
| ▸ | CES1 | P23141 | 4/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.38 |
| ▸ | EPAS1 | Q99814 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 5/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | RECQL | P46063 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | PTPN6 | P29350 | 2/20 | 0.37 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.37 |
| ▸ | NSD1 | Q96L73 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | APAF1 | O14727 | 1/20 | 0.37 |
| ▸ | TERT | O14746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11223995 | 0.80 | CYP1A2 (0.41) | ALDH1A1HPGDKDM4ECES2CES1 | |
| SCHEMBL9770695 | 0.75 | ALDH1A1 (0.37) | ALDH1A1HPGDKDM4ECES2CES1 | |
| SCHEMBL11569207 | 0.75 | RXRA (0.34) | MEN1KMT2ARECQLPPARGBLM | |
| SCHEMBL9629695 | 0.73 | CES1 (0.38) | ALDH1A1HPGDKDM4ECES2CES1 | |
| SCHEMBL24543418 | 0.73 | CES2 (0.43) | ALDH1A1HPGDKDM4ECES2CES1 | |
| SCHEMBL11482020 | 0.72 | — | — | |
| SCHEMBL9770710 | 0.71 | KDM4E (0.36) | ALDH1A1HPGDKDM4EPOLBTP53 | |
| SCHEMBL9770701 | 0.70 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL9079561 | 0.69 | TP53 (0.39) | ALDH1A1HPGDKDM4ECES2CES1 | |
| SCHEMBL19116065 | 0.69 | HDAC4 (0.34) | ALDH1A1HPGDKDM4ECES2CES1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4987261-A | Diaminoindane derivatives | MITSUI TOATSU CHEMICALS, INC. (JP) | 1991-01-22 | — | — | US | disclosed |
| EP-0000936-A1 | 4-Indanyl esters of N-alkyl carbamic acid, processes for their preparation and their use as pesticides | BAYER AG (DE) | 1979-03-07 | — | — | EP | disclosed |