Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.66 |
| ▸ | HPGD | P15428 | 1/20 | 0.66 |
| ▸ | QPCT | Q16769 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 5/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NOX1 | Q9Y5S8 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28644193 | 0.81 | TAAR1 (0.54) | MAPTCYP3A4KMT2AMAOAMAOB | |
| SCHEMBL28033893 | 0.80 | ALDH1A1 (1.00) | MAPTALDH1A1HPGDCYP3A4TAS2R38 | |
| SCHEMBL2404117 | 0.73 | CYP3A4 (0.45) | MAPTALDH1A1QPCTCYP3A4HSD17B10 | |
| SCHEMBL28704185 | 0.73 | — | — | |
| SCHEMBL8956322 | 0.72 | ALDH1A1 (0.94) | MAPTALDH1A1CYP3A4TAS2R38HSD17B10 | |
| SCHEMBL16566469 | 0.71 | ALDH1A1 (0.74) | MAPTALDH1A1CYP3A4TAS2R38HSD17B10 | |
| SCHEMBL27482733 | 0.70 | CYP26A1 (0.42) | MAPTALDH1A1QPCTCYP3A4HSD17B10 | |
| SCHEMBL6598806 | 0.70 | TSHR (0.53) | MAPTALDH1A1CYP3A4HSD17B10KMT2A | |
| SCHEMBL76301 | 0.70 | QPCT (1.00) | ALDH1A1QPCTGAAKMT2AMAOA | |
| SCHEMBL21641770 | 0.70 | HKDC1 (0.42) | MAPTQPCTCYP3A4LMNACA9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1332952-C | 4-substituted imidazole-2-thiones, 4-substituted imidazole-2-ones and related compounds and their use | ALLERGAN INC (US) | 2007-08-22 | — | — | CN | disclosed |
| CN-1671671-A | 4- (substituted cycloalkylmethyl) imidazole-2-thiones, 4- (substituted cycloalkenylmethyl) imidazole-2-thiones, 4- (substituted cycloalkylmethyl) imidazol-2-ones, and 4- (substituted cycloalkenylmethyl) imidazol-2-ones, and related compounds | ALLERGAN INC (US) | 2005-09-21 | — | — | CN | disclosed |