Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10734596 | 0.79 | KDM4E (0.36) | CYP1A2CYP3A4KDM4ECYP2C9CYP2C19 | |
| SCHEMBL237922 | 0.77 | KDM4E (0.35) | CYP1A2CYP3A4KDM4ECYP2C9CYP2C19 | |
| SCHEMBL30352793 | 0.77 | KDM4E (0.35) | CYP1A2CYP3A4KDM4ECYP2C9CYP2C19 | |
| SCHEMBL24663165 | 0.77 | TRPV4 (0.34) | KDM4EALDH1A1MEN1KMT2AADORA2A | |
| SCHEMBL29723241 | 0.77 | TRPV4 (0.34) | KDM4EALDH1A1MEN1KMT2AADORA2A | |
| SCHEMBL20517376 | 0.77 | AR (0.39) | KDM4EUSP2ALDH1A1 | |
| SCHEMBL2428317 | 0.74 | GRM6 (0.41) | CYP1A2CYP3A4KDM4ECYP2C9CYP2C19 | |
| SCHEMBL31399295 | 0.72 | TSHR (0.39) | CYP3A4KDM4EUSP2ALDH1A1MAOA | |
| SCHEMBL152358 | 0.72 | TSHR (0.39) | CYP3A4KDM4EUSP2ALDH1A1MAOA | |
| SCHEMBL2956480 | 0.72 | ALDH1A1 (0.36) | CYP1A2CYP3A4KDM4ECYP2C9CYP2C19 |
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-4754024-A | Fibre-reactive azo dyes containing vinylsulfonyl or analogous groups | CIBA-GEIGY CORPORATION | 1988-06-28 | — | — | US | disclosed |
| EP-0112285-B1 | REACTIVE DYES, THEIR PREPARATION AND THEIR USE | CIBA-GEIGY AG (CH) | 1987-03-18 | — | — | EP | disclosed |
| EP-0052578-B1 | MONOAZO COMPOUNDS | CIBA-GEIGY AG (CH) | 1985-10-09 | — | — | EP | disclosed |
| EP-0112285-A2 | Reactive dyes, their preparation and their use | CIBA-GEIGY AG (CH) | 1984-06-27 | — | — | EP | disclosed |
| US-4447358-A | FOR POLYAMIDE AND WOOL TEXTILE DYEING | CIBA-GEIGY CORPORATION (US) | 1984-05-08 | — | — | US | disclosed |
| EP-0052578-A2 | Monoazo compounds | CIBA-GEIGY AG (CH) | 1982-05-26 | — | — | EP | disclosed |