Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 2/20 | 0.44 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.34 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.33 |
| ▸ | ITGA5 | P08648 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL22806839 | 0.84 | SLCO1B1 (0.41) | TGFBR1KDM4CGABRA5L3MBTL1ABCB11 | |
| SCHEMBL29067845 | 0.83 | ABCB11 (0.38) | TGFBR1KDM4CGABRA5L3MBTL1ABCB11 | |
| SCHEMBL30740333 | 0.83 | KDM4C (0.37) | TGFBR1KDM4CL3MBTL1ABCB11SLCO1B1 | |
| SCHEMBL22576664 | 0.83 | KDM4C (0.37) | TGFBR1KDM4CL3MBTL1ABCB11SLCO1B1 | |
| SCHEMBL31008992 | 0.81 | KDM4C (0.36) | KDM4CGABRA5L3MBTL1NPC1RAB9A | |
| SCHEMBL24982985 | 0.80 | SLCO1B1 (0.39) | TGFBR1KDM4CL3MBTL1ABCB11SLCO1B1 | |
| SCHEMBL19728935 | 0.80 | ABCB11 (0.34) | KDM4CL3MBTL1ABCB11SLCO1B1NPC1 | |
| SCHEMBL23671228 | 0.80 | ABCB11 (0.35) | KDM4CGABRA5L3MBTL1ABCB11SLCO1B1 | |
| SCHEMBL30460219 | 0.80 | KDM4C (0.34) | TGFBR1KDM4CL3MBTL1TGFBR2NPC1 | |
| SCHEMBL30460098 | 0.79 | TGFBR1 (0.36) | TGFBR1KDM4CGABRA5SLCO1B1TGFBR2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024022314-A1 | TRIAZOLE COMPOUNDS AND USE THEREOF AS LPAR1 ANTAGONIST | 武汉人福创新药物研发中心有限公司 | 2024-02-01 | — | — | WO | disclosed |