Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.74 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.71 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.48 |
| ▸ | RECQL | P46063 | 3/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.48 |
| ▸ | EGFR | P00533 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | FYN | P06241 | 2/20 | 0.48 |
| ▸ | MMP9 | P14780 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Orthocresol SCHEMBL9805651 | 0.91 | ALDH1A1 (0.61) | ALDH1A1TRPA1ATMCYP1A2CYP2C19 | |
| Orthocresol SCHEMBL11149192 | 0.91 | ALDH1A1 (0.61) | ALDH1A1TRPA1ATMCYP1A2CYP2C19 | |
| Pyrogallol SCHEMBL8609213 | 0.90 | TRPA1 (0.71) | ALDH1A1TRPA1ATMCYP1A2CYP2C19 | |
| Orthocresol SCHEMBL170162 | 0.89 | TRPA1 (0.60) | ALDH1A1TRPA1ATMCYP1A2CYP2C19 | |
| Orthocresol SCHEMBL16002 | 0.89 | — | — | |
| Orthocresol SCHEMBL8710164 | 0.89 | TRPA1 (0.60) | ALDH1A1TRPA1ATMCYP1A2CYP2C19 | |
| Orthocresol SCHEMBL10419161 | 0.89 | TRPA1 (0.60) | ALDH1A1TRPA1ATMCYP1A2CYP2C19 | |
| Orthocresol SCHEMBL29395276 | 0.89 | — | — | |
| Orthocresol SCHEMBL9719795 | 0.86 | TRPA1 (0.57) | ALDH1A1TRPA1ATMCYP1A2CYP2C19 | |
| Orthocresol SCHEMBL3407681 | 0.86 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5789628-A | FROM PHENOL AND CARBONYL COMPOUND | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1998-08-04 | — | — | US | disclosed |
| US-4517389-A | METAL OXIDE CATALYST, FLUIDIZED BED | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1985-05-14 | — | — | US | disclosed |
| US-4468508-A | Glycidyl ether of novolak type substituted phenolic resin, process for producing the same, and encapsulating compound composed mainly of the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1984-08-28 | — | — | US | disclosed |
| EP-0019476-A2 | Catalyst and process for producing ortho-methyl substituted phenols using it | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1980-11-26 | — | — | EP | disclosed |
| US-3953529-A | IRON OXIDE, SILICA, AND CHROMIUM OXIDE CATALYST | MITSUBISHI GAS CHEMICAL CO. INC. (JA) | 1976-04-27 | — | — | US | disclosed |
| US-3937669-A | VANADIUM OXIDE | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JA) | 1976-02-10 | — | — | US | disclosed |