Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.44 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | GGT1 | P19440 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6984312 | 0.78 | NPC1 (0.51) | NPC1MAPK1KDM4EALDH1A1HPGD | |
| SCHEMBL17742692 | 0.76 | NPC1 (0.49) | NPC1MAPK1KDM4EALDH1A1MEN1 | |
| SCHEMBL14542966 | 0.75 | MAPK1 (0.51) | NPC1MAPK1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL27835516 | 0.74 | MAPK1 (0.47) | NPC1MAPK1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL20897188 | 0.74 | ALDH1A1 (0.49) | NPC1MAPK1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL5511363 | 0.74 | IDO1 (0.53) | NPC1MAPK1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL11489059 | 0.74 | KDM4E (0.40) | NPC1MAPK1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL11489053 | 0.74 | KDM4E (0.40) | NPC1MAPK1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL27831730 | 0.74 | HCRTR2 (0.42) | NPC1MAPK1KDM4EALDH1A1MEN1 | |
| SCHEMBL27514497 | 0.73 | ALDH1A1 (0.50) | MAPK1KDM4EALDH1A1TSHRESR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101010315-A | Substituted pyrazolyl urea derivatives useful in the treatment of cancer | BAYER PHARMACEUTICALS CORP (US) | 2007-08-01 | — | — | CN | claimed |
| CN-101010315-A | Substituted pyrazolyl urea derivatives useful in the treatment of cancer | BAYER PHARMACEUTICALS CORP (US) | 2007-08-01 | — | — | CN | disclosed |