Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.66 |
| ▸ | NPC1 | O15118 | 1/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.65 |
| ▸ | USP2 | O75604 | 2/20 | 0.65 |
| ▸ | HPGD | P15428 | 1/20 | 0.65 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.62 |
| ▸ | DRD3 | P35462 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.54 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 1/20 | 0.54 |
| ▸ | SCN1A | P35498 | 1/20 | 0.54 |
| ▸ | HTR2B | P41595 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.54 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.54 |
| ▸ | LTA4H | P09960 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7954349 | 0.92 | LTA4H (0.63) | RAB9ANPC1ALDH1A1USP2HPGD | |
| SCHEMBL23291197 | 0.87 | HRH3 (0.68) | RAB9ANPC1ALDH1A1USP2HPGD | |
| SCHEMBL7956510 | 0.86 | HRH3 (0.72) | HRH3KCNH2MEN1KMT2A | |
| SCHEMBL2827360 | 0.85 | HRH3 (0.75) | HRH3KCNH2 | |
| SCHEMBL8360712 | 0.85 | RAB9A (0.68) | RAB9ANPC1ALDH1A1USP2HPGD | |
| SCHEMBL10817906 | 0.83 | RAB9A (0.76) | RAB9ANPC1ALDH1A1USP2HPGD | |
| SCHEMBL12359053 | 0.83 | USP2 (0.91) | RAB9ANPC1ALDH1A1USP2HPGD | |
| SCHEMBL16301445 | 0.83 | RAB9A (0.66) | RAB9ANPC1ALDH1A1USP2HPGD | |
| SCHEMBL76269 | 0.83 | RAB9A (0.66) | RAB9ANPC1ALDH1A1USP2HPGD | |
| SCHEMBL19091219 | 0.83 | RAB9A (0.79) | RAB9ANPC1ALDH1A1USP2HPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6297274-B1 | SUBSTITUTED 5-HYDROXYFURANONES | WARNER-LAMBERT COMPANY | 2001-10-02 | — | — | US | claimed |
| WO-1997037985-A1 | NONPEPTIDE ENDOTHELIN ANTAGONISTS WITH INCREASED WATER SOLUBILITY | WARNER-LAMBERT COMPANY (US) | 1997-10-16 | — | — | WO | claimed |
| US-6297274-B1 | SUBSTITUTED 5-HYDROXYFURANONES | WARNER-LAMBERT COMPANY | 2001-10-02 | — | — | US | disclosed |
| WO-1997037985-A1 | NONPEPTIDE ENDOTHELIN ANTAGONISTS WITH INCREASED WATER SOLUBILITY | WARNER-LAMBERT COMPANY (US) | 1997-10-16 | — | — | WO | disclosed |