Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.31 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20341874 | 0.92 | CYP3A4 (0.30) | CYP3A4ALOX15CHRNB2NFKB1MAPK1 | |
| SCHEMBL15046469 | 0.70 | CYP3A4 (0.31) | CYP3A4ALOX15CHRNB2NFKB1MAPK1 | |
| SCHEMBL14022647 | 0.66 | CHRNB2 (0.34) | CHRNB2CHRNA3CHRNA7CHRNA4 | |
| SCHEMBL15046481 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL15302542 | 0.61 | CYP3A4 (0.41) | CYP3A4ALOX15CHRNB2NFKB1MAPK1 | |
| Hydrochloric Acid SCHEMBL3636535 | 0.60 | CYP3A4 (0.41) | CYP3A4ALOX15CHRNB2NFKB1MAPK1 | |
| SCHEMBL3852468 | 0.59 | CYP3A4 (0.39) | CYP3A4ALOX15CHRNB2NFKB1MAPK1 | |
| Hydrochloric Acid SCHEMBL1982671 | 0.56 | CYP3A4 (0.35) | CYP3A4ALOX15CHRNB2NFKB1MAPK1 | |
| SCHEMBL6743986 | 0.54 | ALOX15 (0.64) | CYP3A4ALOX15CHRNB2NFKB1MAPK1 | |
| SCHEMBL24752954 | 0.53 | — | — |
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-2008138845-A2 | COLOURING COMPOSITION COMPRISING AN AMINOPYRAZOLOPYRIDINE OXIDATION BASE AND EXHIBITING AN ACIDIC PH | L'OREAL (FR) | 2008-11-20 | — | — | WO | disclosed |