Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.32 |
| ▸ | MCOLN3 | Q8TDD5 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL8795263 | 0.74 | — | — | |
| SCHEMBL8795642 | 0.73 | SMPD3 (0.31) | — | |
| SCHEMBL2523197 | 0.73 | CYP1A2 (0.39) | ALDH1A1LMNAPOLBMAPTCYP1A2 | |
| SCHEMBL4201118 | 0.71 | CYP1A2 (0.36) | ALDH1A1LMNAPOLBMAPTCYP1A2 | |
| SCHEMBL26644039 | 0.65 | LRRK2 (0.38) | ALDH1A1LMNAPOLBMAPTCYP1A2 | |
| SCHEMBL15528301 | 0.65 | ALDH1A1 (0.41) | ALDH1A1LMNAPOLBMAPTCYP1A2 | |
| SCHEMBL31569009 | 0.65 | MAPT (0.36) | ALDH1A1LMNAPOLBMAPTPKM | |
| SCHEMBL30320387 | 0.64 | CYP11B2 (0.36) | LMNA | |
| SCHEMBL15528227 | 0.63 | LRRK2 (0.37) | ALDH1A1POLBPKMCYP2C9CYP3A4 | |
| SCHEMBL22421100 | 0.62 | ALDH1A1 (0.34) | ALDH1A1MAPTMCOLN3MEN1KMT2A |
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-0562061-B1 | HAIR-DYEING AGENT CONTAINING AMINOPYRAZOLE DERIVATIVES, AND NEW PYRAZOLE DERIVATIVES | WELLA AG (DE) | 1997-01-22 | — | — | EP | claimed |
| US-5380340-A | Hair dye containing aminopyrazole derivatives as well as pyrazole derivatives | WELLA AKTIENGESELLSCHAFT (DE) | 1995-01-10 | — | — | US | claimed |
| EP-0562061-B1 | HAIR-DYEING AGENT CONTAINING AMINOPYRAZOLE DERIVATIVES, AND NEW PYRAZOLE DERIVATIVES | WELLA AG (DE) | 1997-01-22 | — | — | EP | disclosed |
| US-5380340-A | Hair dye containing aminopyrazole derivatives as well as pyrazole derivatives | WELLA AKTIENGESELLSCHAFT (DE) | 1995-01-10 | — | — | US | disclosed |