Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.42 |
| ▸ | PRKCB | P05771 | 8/20 | 0.40 |
| ▸ | PRKCE | Q02156 | 7/20 | 0.40 |
| ▸ | PRKCA | P17252 | 7/20 | 0.40 |
| ▸ | PRKD3 | O94806 | 6/20 | 0.40 |
| ▸ | PRKCG | P05129 | 6/20 | 0.40 |
| ▸ | PRKCH | P24723 | 6/20 | 0.40 |
| ▸ | PRKCI | P41743 | 6/20 | 0.40 |
| ▸ | PRKCQ | Q04759 | 6/20 | 0.40 |
| ▸ | PRKCZ | Q05513 | 6/20 | 0.40 |
| ▸ | PRKCD | Q05655 | 6/20 | 0.40 |
| ▸ | PRKD1 | Q15139 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31669073 | 1.00 | CYP1A2 (0.42) | CYP1A2TSHRCYP2A6PRKCBPRKCE | |
| SCHEMBL11882241 | 0.84 | PRKCB (0.40) | CYP1A2TSHRPRKCBPRKCEPRKCA | |
| SCHEMBL5405972 | 0.83 | DNMT1 (0.45) | CYP1A2PRKCBPRKCEPRKCAPRKD3 | |
| SCHEMBL505505 | 0.78 | DAO (0.40) | PRKCBPRKCEPRKCAPRKD3PRKCG | |
| SCHEMBL1305138 | 0.78 | SIRT2 (0.40) | CYP1A2PRKCBPRKCEPRKCAPRKD3 | |
| SCHEMBL3182292 | 0.76 | ALDH1A1 (0.44) | TSHRPRKCBPRKCEPRKCAPRKD3 | |
| SCHEMBL2544260 | 0.73 | PTPN1 (0.53) | PRKCBPRKCEPRKCAPRKD3PRKCG | |
| SCHEMBL6513808 | 0.73 | HKDC1 (0.54) | CYP1A2TSHRCYP2A6ALDH1A1KDM4E | |
| SCHEMBL2951616 | 0.73 | TSHR (0.65) | CYP1A2TSHRCYP2A6ALDH1A1HPGD | |
| SCHEMBL29352216 | 0.73 | TSHR (0.65) | CYP1A2TSHRCYP2A6ALDH1A1HPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5424324-A | Stabilized microbiocides | ROHM AND HAAS COMPANY (US) | 1995-06-13 | — | — | US | claimed |
| EP-0435439-A2 | Aldehyde stabilizers for 3-isothiazolones | ROHM AND HAAS COMPANY (US) | 1991-07-03 | — | — | EP | claimed |
| US-5424324-A | Stabilized microbiocides | ROHM AND HAAS COMPANY (US) | 1995-06-13 | — | — | US | disclosed |
| EP-0435439-A2 | Aldehyde stabilizers for 3-isothiazolones | ROHM AND HAAS COMPANY (US) | 1991-07-03 | — | — | EP | disclosed |