Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.50 |
| ▸ | HPGD | P15428 | 10/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 9/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.50 |
| ▸ | GLA | P06280 | 4/20 | 0.50 |
| ▸ | CA9 | Q16790 | 4/20 | 0.50 |
| ▸ | GAA | P10253 | 4/20 | 0.50 |
| ▸ | CASP1 | P29466 | 3/20 | 0.50 |
| ▸ | CASP7 | P55210 | 3/20 | 0.50 |
| ▸ | CA1 | P00915 | 3/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.42 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9479907 | 0.83 | ALDH1A1 (0.41) | ALDH1A1HPGDHSD17B10KDM4EGLA | |
| SCHEMBL8247621 | 0.75 | CYP2A6 (0.43) | ALDH1A1HPGDHSD17B10KDM4EGLA | |
| SCHEMBL2169023 | 0.74 | ALDH1A1 (0.74) | ALDH1A1HPGDHSD17B10KDM4EGLA | |
| SCHEMBL29478204 | 0.72 | NQO1 (0.44) | ALDH1A1HPGDHSD17B10KDM4EGLA | |
| SCHEMBL4922429 | 0.72 | ALDH1A1 (0.47) | ALDH1A1HPGDHSD17B10KDM4EGLA | |
| SCHEMBL467454 | 0.72 | NQO1 (0.44) | ALDH1A1HPGDHSD17B10KDM4EGLA | |
| SCHEMBL8750160 | 0.69 | ALDH1A1 (0.58) | ALDH1A1HPGDHSD17B10KDM4EGLA | |
| SCHEMBL14627838 | 0.68 | NQO1 (0.44) | ALDH1A1HPGDHSD17B10KDM4EGLA | |
| SCHEMBL6703952 | 0.67 | ALDH1A1 (0.74) | ALDH1A1HPGDHSD17B10KDM4EGLA | |
| SCHEMBL14273317 | 0.67 | ALDH1A1 (0.64) | ALDH1A1HPGDHSD17B10KDM4EGLA |
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-0553248-A1 | NOVEL 5-IODO-6-AMINO-1,2-BENZOPYRONES AND THEIR ANALOGS USEFUL AS CYTOSTATIC AND ANTIVIRAL AGENTS. | UNIV CALIFORNIA (US) | 1993-08-04 | — | — | EP | disclosed |
| WO-1992006687-A1 | NOVEL 5-IODO-6-AMINO-1,2-BENZOPYRONES AND THEIR ANALOGS USEFUL AS CYTOSTATIC AND ANTIVIRAL AGENTS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1992-04-30 | — | — | WO | disclosed |