Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.62 |
| ▸ | RAB9A | P51151 | 1/20 | 0.62 |
| ▸ | TRPM8 | Q7Z2W7 | 6/20 | 0.54 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.54 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.52 |
| ▸ | BCHE | P06276 | 1/20 | 0.52 |
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.47 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5881684 | 0.82 | AKR1C3 (0.73) | AKR1C3AKR1C2PTGS2ALDH1A1TSHR | |
| SCHEMBL8623784 | 0.81 | GAA (0.57) | AKR1C3AKR1C2PTGS2ALDH1A1TSHR | |
| SCHEMBL10013763 | 0.79 | NPC1 (0.81) | NPC1RAB9ATRPM8ALDH1A1TSHR | |
| SCHEMBL23582865 | 0.78 | TSHR (0.51) | AKR1C3AKR1C2PTGS2ALDH1A1TSHR | |
| SCHEMBL5283268 | 0.77 | ALOX5 (0.46) | NPC1RAB9ATRPM8PTGS2 | |
| SCHEMBL5000931 | 0.77 | KMT2A (0.55) | AKR1C3AKR1C2BCHEACHEALDH1A1 | |
| SCHEMBL7403967 | 0.76 | GPR88 (0.59) | AKR1C3AKR1C2PTGS2 | |
| SCHEMBL4010768 | 0.76 | TRPM8 (0.67) | NPC1RAB9ATRPM8 | |
| SCHEMBL23358696 | 0.76 | POLB (0.69) | NPC1RAB9ATRPM8 | |
| SCHEMBL14599721 | 0.76 | GPR88 (0.59) | AKR1C3AKR1C2PTGS2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1912645-A2 | THERAPEUTIC AGENT FOR DIABETES | Takeda Pharmaceutical Company Limited (JP) | 2008-04-23 | — | — | EP | disclosed |
| WO-2007018314-A2 | THERAPEUTIC AGENT FOR DIABETES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-02-15 | — | — | WO | disclosed |