Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 6/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 7/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
| ▸ | PIM2 | Q9P1W9 | 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 | |
|---|---|---|---|---|
| SCHEMBL8399113 | 0.89 | NOS1 (0.44) | AKR1B1ERBB2NOS1 | |
| SCHEMBL8395435 | 0.86 | AKR1B1 (0.38) | AKR1B1 | |
| SCHEMBL8399351 | 0.86 | AKR1B1 (0.46) | AKR1B1NOS1 | |
| SCHEMBL8399732 | 0.85 | AKR1B1 (0.42) | AKR1B1 | |
| SCHEMBL8395427 | 0.83 | EGFR (0.38) | KDRDRD4DRD3EGFRERBB2 | |
| SCHEMBL8395489 | 0.82 | AKR1B1 (0.39) | AKR1B1 | |
| SCHEMBL8400189 | 0.81 | AKR1B1 (0.36) | AKR1B1NOS1 | |
| SCHEMBL8399257 | 0.81 | SYK (0.44) | AKR1B1 | |
| SCHEMBL8395478 | 0.81 | AKR1B1 (0.42) | AKR1B1 | |
| SCHEMBL8396103 | 0.80 | AKR1B1 (0.41) | AKR1B1ERBB2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0647636-B1 | BENZOTHIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF | SENJU PHARMA CO (JP) | 1999-06-09 | — | — | EP | disclosed |
| US-5532257-A | ENZYME INHIBITOR | SENJU PHARMACEUTICAL CO., LTD (JP) | 1996-07-02 | — | — | US | disclosed |
| EP-0647636-A1 | BENZOTHIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF | Senju Pharmaceutical Co., Ltd. (JP) | 1995-04-12 | — | — | EP | disclosed |