Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 3/20 | 0.42 |
| ▸ | ALDH1A2 | O94788 | 2/20 | 0.42 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.42 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.42 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9538121 | 0.84 | KDM4E (0.42) | ALDH1A1TSHRKDM4EMAPTHPGD | |
| Hydrochloric Acid SCHEMBL9537163 | 0.84 | KDM4E (0.42) | ALDH1A1TSHRKDM4EMAPTHPGD | |
| SCHEMBL9537827 | 0.82 | TSHR (0.46) | ALDH1A1TSHRKDM4EMAPTHPGD | |
| Hydrochloric Acid SCHEMBL9537839 | 0.81 | HSD17B10 (0.52) | ALDH1A1TSHRKDM4EMAPTHPGD | |
| SCHEMBL9536891 | 0.81 | ALDH1A1 (0.47) | ALDH1A1TSHRKDM4EMAPTHPGD | |
| SCHEMBL8561156 | 0.81 | ALDH1A1 (0.42) | ALDH1A1TSHRKDM4EMAPTHPGD | |
| SCHEMBL9537236 | 0.81 | MAPT (0.50) | ALDH1A1TSHRKDM4EMAPTHPGD | |
| SCHEMBL8138405 | 0.81 | MEN1 (0.51) | ALDH1A1MAPTSMN1; SMN2CYP1A2MEN1 | |
| SCHEMBL14173582 | 0.80 | KCNH2 (0.50) | NOS2MEN1KMT2A | |
| SCHEMBL9382951 | 0.79 | BRD4 (0.41) | ALDH1A1TSHRKDM4EMAPTHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-5360807-A | Substituted thiazolyl and substituted pyridinyl derivatives | JANSSEN PHARMACEUTICA N.V. (BF) | 1994-11-01 | — | — | US | disclosed |
| EP-0539420-A1 | NOVEL SUBSTITUTED THIAZOLYL AND SUBSTITUTED PYRIDINYL DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-05-05 | — | — | EP | disclosed |
| WO-1992001697-A1 | NOVEL SUBSTITUTED THIAZOLYL AND SUBSTITUTED PYRIDINYL DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1992-02-06 | — | — | WO | disclosed |