Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 6/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 5/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.33 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.33 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
| ▸ | ABCC4 | O15439 | 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 | |
|---|---|---|---|---|
| SCHEMBL27338997 | 0.86 | MCL1 (0.41) | HPRT1ACHEALDH1A1CYP1A2ADORA3 | |
| SCHEMBL27913357 | 0.85 | MAPT (0.39) | HPRT1ACHEALDH1A1CYP1A2ADORA3 | |
| SCHEMBL27360260 | 0.83 | HPRT1 (0.36) | HPRT1ACHEALDH1A1CYP1A2ADORA3 | |
| Benzidine SCHEMBL27870798 | 0.81 | KIF11 (0.43) | HPRT1ACHEALDH1A1CYP1A2ADORA3 | |
| SCHEMBL27440395 | 0.81 | HPRT1 (0.50) | HPRT1ACHEALDH1A1CYP1A2ADORA3 | |
| SCHEMBL30928215 | 0.81 | HPRT1 (0.54) | HPRT1ACHEALDH1A1CYP1A2ADORA3 | |
| SCHEMBL21176632 | 0.81 | HPRT1 (0.54) | HPRT1ACHEALDH1A1CYP1A2ADORA3 | |
| SCHEMBL28077721 | 0.81 | HPRT1 (0.54) | HPRT1ACHEALDH1A1CYP1A2ADORA3 | |
| SCHEMBL2089665 | 0.81 | HPRT1 (0.54) | HPRT1ACHEALDH1A1CYP1A2ADORA3 | |
| Phenanthrene SCHEMBL27372954 | 0.81 | HPRT1 (0.54) | HPRT1ACHEALDH1A1CYP1A2ADORA3 |
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 |