Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18901280 | 0.78 | SMN1; SMN2 (0.43) | SMN1; SMN2HTTKDM4ENPC1ALDH1A1 | |
| SCHEMBL2315615 | 0.77 | SMN1; SMN2 (0.40) | SMN1; SMN2HTTRECQLKDM4ENPC1 | |
| SCHEMBL9051738 | 0.74 | ALDH1A1 (0.36) | SMN1; SMN2HTTRECQLKDM4ENPC1 | |
| SCHEMBL9051329 | 0.73 | ALDH1A1 (0.35) | SMN1; SMN2HTTRECQLKDM4ENPC1 | |
| SCHEMBL9050183 | 0.73 | ADORA2A (0.38) | ADORA3ADORA2AADORA1 | |
| SCHEMBL28892524 | 0.71 | — | — | |
| SCHEMBL28052581 | 0.71 | RECQL (0.40) | SMN1; SMN2HTTRECQLKDM4ENPC1 | |
| SCHEMBL267216 | 0.70 | — | — | |
| SCHEMBL21032673 | 0.69 | SMN1; SMN2 (0.40) | SMN1; SMN2HTTRECQLKDM4ENPC1 | |
| Hydrochloric Acid SCHEMBL23248486 | 0.68 | RECQL (0.49) | SMN1; SMN2HTTRECQLKDM4ENPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996034591-A1 | DIAMINOPYRAZOLE-CONTAINING COMPOSITIONS FOR COLOURING KERATIN FIBRES, COLOURING PROCESS, NOVEL DIAMINOPYRAZOLES AND METHOD FOR THEIR PREPARATION | L'OREAL (FR) | 1996-11-07 | — | — | WO | claimed |