Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.32 |
| ▸ | XDH | P47989 | 2/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8326642 | 0.85 | LMNA (0.47) | ERN1LMNAALDH1A1KDM4E | |
| SCHEMBL8328987 | 0.82 | LMNA (0.39) | ERN1LMNAMAPTALDH1A1KDM4E | |
| SCHEMBL8328118 | 0.73 | ALDH1A1 (0.42) | ERN1MAPTCYP2C9CYP2C19S1PR1 | |
| SCHEMBL12896131 | 0.72 | NOTUM (0.45) | MAPTCYP1A2XDHKMT2A | |
| SCHEMBL6097515 | 0.72 | ERN1 (0.51) | ERN1MAPTFFAR4CYP1A2CYP2C9 | |
| SCHEMBL8322837 | 0.72 | ALDH1A1 (0.56) | ERN1MAPTFFAR4CYP1A2CYP2C9 | |
| SCHEMBL12896130 | 0.71 | GABRA1 (0.48) | MAPTFFAR4 | |
| SCHEMBL8322244 | 0.70 | ACLY (0.39) | ERN1LMNAMAPTS1PR1XDH | |
| SCHEMBL28587918 | 0.70 | XDH (0.40) | LMNAXDHALDH1A1KDM4EMEN1 | |
| SCHEMBL6098469 | 0.70 | ERN1 (0.45) | ERN1MAPTFFAR4XDHALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0858444-A4 | CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 1999-12-01 | — | — | EP | disclosed |
| EP-0858444-A1 | CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 1998-08-19 | — | — | EP | disclosed |
| WO-1997014671-A1 | CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1997-04-24 | — | — | WO | disclosed |