Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7134324 | 0.70 | TSHR (0.41) | TSHRKDM4EHSD17B10CA12CA2 | |
| SCHEMBL7134321 | 0.69 | CA12 (0.43) | TSHRKDM4EHSD17B10CA12CA2 | |
| SCHEMBL8134865 | 0.68 | PDK2 (0.35) | TSHRKDM4EHSD17B10ALDH1A1KMT2A | |
| SCHEMBL8136245 | 0.67 | TSHR (0.38) | TSHRKDM4EHSD17B10CA12CA2 | |
| SCHEMBL7890058 | 0.66 | TSHR (0.40) | TSHRKDM4EHSD17B10CA12CA2 | |
| SCHEMBL23773427 | 0.66 | TSHR (0.68) | TSHRKDM4EHSD17B10CA12CA2 | |
| SCHEMBL6613660 | 0.65 | KMT2A (0.59) | TSHRCA12CA2CA7CA9 | |
| SCHEMBL7131946 | 0.65 | ALDH1A1 (0.39) | TSHRKDM4EHSD17B10ALDH1A1MAPK1 | |
| SCHEMBL28750763 | 0.64 | ALDH1A1 (0.51) | TSHRKDM4EHSD17B10CA12CA2 | |
| SCHEMBL11678098 | 0.63 | TSHR (0.63) | TSHRKDM4EHSD17B10CA12CA2 |
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-6159904-A | Pyrazole derivatives | IDEMITSU KOSAN CO., LTD. (JP) | 2000-12-12 | — | — | US | disclosed |
| EP-0970956-A1 | PYRAZOLE DERIVATIVES | IDEMITSU KOSAN COMPANY LIMITED (JP) | 2000-01-12 | — | — | EP | disclosed |