Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.62 |
| ▸ | DRD3 | P35462 | 3/20 | 0.62 |
| ▸ | EGFR | P00533 | 1/20 | 0.52 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ABL1 | P00519 | 1/20 | 0.47 |
| ▸ | SRC | P12931 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | XDH | P47989 | 2/20 | 0.45 |
| ▸ | CXCR1 | P25024 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28032867 | 0.90 | HRH3 (0.62) | HRH3DRD3EGFRHRH4NPC1 | |
| SCHEMBL2436023 | 0.86 | HRH3 (0.54) | HRH3EGFRHRH1USP2ALDH1A1 | |
| SCHEMBL30209182 | 0.86 | HRH3 (0.49) | HRH3DRD3EGFRHRH1CYP2D6 | |
| SCHEMBL18128966 | 0.84 | EGFR (0.54) | HRH3DRD3EGFRUSP2ALDH1A1 | |
| SCHEMBL28126949 | 0.83 | LTA4H (0.53) | HRH3EGFRNPC1RAB9A | |
| SCHEMBL7837580 | 0.80 | HRH3 (0.53) | HRH3EGFR | |
| SCHEMBL5680969 | 0.79 | HRH3 (0.55) | HRH3 | |
| SCHEMBL1383554 | 0.78 | EGFR (0.43) | HRH3DRD3EGFRHRH1ABL1 | |
| SCHEMBL10807692 | 0.78 | HRH3 (0.70) | HRH3DRD3HRH4NPC1RAB9A | |
| SCHEMBL3067381 | 0.77 | HRH3 (0.54) | HRH3EGFRHRH1USP2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101090899-B | 2,5 and 2,6 disubstituted benzazole analogs useful as protein kinase inhibitors | 4SC Corp. (DE) | 2015-09-09 | — | — | CN | disclosed |