Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.76 |
| ▸ | POLB | P06746 | 1/20 | 0.76 |
| ▸ | HTT | P42858 | 1/20 | 0.76 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 3/20 | 0.48 |
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.48 |
| ▸ | CDK1 | P06493 | 1/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL6290092 | 0.86 | HPGD (1.00) | HPGDPOLBHTTKDM4EALDH1A1 | |
| SCHEMBL10186383 | 0.85 | CYP1A2 (0.58) | HPGDPOLBHTTOPRM1ALDH1A1 | |
| SCHEMBL11092370 | 0.84 | HPGD (0.62) | HPGDPOLBHTTKDM4EALDH1A1 | |
| SCHEMBL11680022 | 0.82 | HPGD (0.73) | HPGDPOLBHTTKDM4EALDH1A1 | |
| SCHEMBL19835598 | 0.82 | HPGD (0.73) | HPGDPOLBHTTKDM4EALDH1A1 | |
| SCHEMBL13091311 | 0.81 | CYP1A2 (0.53) | HPGDPOLBHTTOPRM1ALDH1A1 | |
| SCHEMBL9705706 | 0.81 | HPGD (0.67) | HPGDPOLBHTTKDM4EALDH1A1 | |
| SCHEMBL9668044 | 0.80 | ESRRG (0.60) | HPGDPOLBHTTKDM4EALDH1A1 | |
| SCHEMBL9668023 | 0.80 | ESRRG (0.59) | HPGDPOLBHTTKDM4EALDH1A1 | |
| SCHEMBL29195064 | 0.80 | CA2 (0.62) | HPGDPOLBHTTOPRM1KDM4E |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5002960-A | Viricides for combating picornaviruses | STERLING DRUG, INC. (US) | 1991-03-26 | — | — | US | disclosed |
| US-4985365-A | WITH AN ESTERASE FROM A MICROORGANISM, ASSYMETRIC HYDROLYSIS | SUMITOMO CHEMICAL COMPANY, LTD. (JP) | 1991-01-15 | — | — | US | disclosed |
| US-4939267-A | Viricides | STERLING DRUG INC. (US) | 1990-07-03 | — | — | US | disclosed |
| US-4843087-A | OXAZOLINYL COMPOUNDS; RHINOVIRUSES AND PICORNAVIRUSES | STERLING DRUG INC. (US) | 1989-06-27 | — | — | US | disclosed |
| EP-0080827-A2 | Method for biotechnologically preparing (S)-(-)-alpha-cyano-3-phenoxybenzyl alcohol | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1983-06-08 | — | — | EP | disclosed |