Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 15/20 | 0.68 |
| ▸ | ABCC1 | P33527 | 3/20 | 0.68 |
| ▸ | CTSL | P07711 | 1/20 | 0.55 |
| ▸ | CTSB | P07858 | 1/20 | 0.55 |
| ▸ | CTSS | P25774 | 1/20 | 0.55 |
| ▸ | CTSK | P43235 | 1/20 | 0.55 |
| ▸ | PDE5A | O76074 | 1/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL16392074 | 0.84 | ABCG2 (0.58) | ABCG2ABCC1PDE5AABCB1NPC1 | |
| SCHEMBL12485644 | 0.81 | CTSL (0.57) | ABCG2CTSLCTSBCTSSCTSK | |
| SCHEMBL16392238 | 0.78 | ABCG2 (0.59) | ABCG2ABCC1ABCB1NPC1RAB9A | |
| SCHEMBL16391564 | 0.78 | ABCG2 (0.50) | ABCG2ABCC1PDE5AABCB1NPC1 | |
| SCHEMBL3475933 | 0.77 | NPC1 (0.67) | ABCG2CTSLCTSBCTSSCTSK | |
| SCHEMBL16391879 | 0.76 | ABCG2 (0.48) | ABCG2ABCC1PDE5AABCB1NPC1 | |
| SCHEMBL27223333 | 0.74 | ABCG2 (0.68) | ABCG2CTSLCTSBCTSSCTSK | |
| SCHEMBL16392241 | 0.74 | ABCG2 (0.48) | ABCG2ABCC1PDE5AABCB1NPC1 | |
| SCHEMBL5032293 | 0.73 | CTSL (0.76) | ABCG2CTSLCTSBCTSSCTSK | |
| SCHEMBL13309931 | 0.73 | ADORA1 (0.63) | PDE5ANPC1RAB9AKDM4EKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0298041-B1 | Reactive dyes, their preparation and their use | CIBA GEIGY AG (CH) | 1994-06-08 | — | — | EP | disclosed |
| US-4975530-A | 4,6-diaminopyrimidine or the like intermediates for the preparation of fiber-reactive dyes | CIBA-GEIGY CORPORATION (US) | 1990-12-04 | — | — | US | disclosed |
| US-4900813-A | Fiber-reactive azo dyes having a 4,6-diaminopyridine coupling component | CIBA-GEIGY CORPORATION (US) | 1990-02-13 | — | — | US | disclosed |
| EP-0298041-A2 | Reactive dyes, their preparation and their use | CIBA-GEIGY AG (CH) | 1989-01-04 | — | — | EP | disclosed |