Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 8/20 | 0.41 |
| ▸ | KDR | P35968 | 4/20 | 0.39 |
| ▸ | MET | P08581 | 2/20 | 0.39 |
| ▸ | PIM1 | P11309 | 2/20 | 0.39 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.39 |
| ▸ | VCP | P55072 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | CCR3 | P51677 | 1/20 | 0.38 |
| ▸ | BRAF | P15056 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7980998 | 0.91 | VCP (0.47) | ABCG2KDRMETPIM1PIM2 | |
| SCHEMBL7981286 | 0.81 | MTOR (0.48) | ABCG2KDRMETVCPCYP1A2 | |
| SCHEMBL7125034 | 0.75 | RIPK2 (0.42) | ABCG2BRAFMEN1LMNACYP1A2 | |
| SCHEMBL7119901 | 0.72 | ABCG2 (0.47) | ABCG2MEN1LMNAMAPTHPGD | |
| SCHEMBL7122153 | 0.72 | ABL1 (0.48) | ABCG2PIM1PIM2BRAFLMNA | |
| SCHEMBL7127026 | 0.71 | AHR (0.53) | ABCG2KDRBRAFMEN1LMNA | |
| SCHEMBL7967916 | 0.70 | KDR (0.48) | KDRVCPBRAFLMNACYP1A2 | |
| SCHEMBL2049365 | 0.68 | NISCH (0.52) | CASP6MEN1KMT2AMTORADK | |
| SCHEMBL1688521 | 0.68 | NISCH (0.60) | PIM1VCPMEN1CYP1A2CYP3A4 | |
| SCHEMBL771236 | 0.68 | NISCH (0.64) | MEN1CYP1A2CYP3A4CYP2D6MAPT |
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-2001087845-A2 | N-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE AS 5-HT ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-11-22 | — | — | WO | disclosed |