Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MYC | P01106 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.37 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.37 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.37 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6574642 | 0.90 | LTB4R2 (0.43) | MAPK1LTB4R2KDM4EALDH1A1POLB | |
| SCHEMBL6573626 | 0.85 | F2 (0.35) | MAPK1ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL6575016 | 0.85 | HTT (0.42) | MAPK1LTB4R2KDM4EALDH1A1POLB | |
| SCHEMBL6571124 | 0.82 | F2 (0.36) | KDM4EALDH1A1POLBGAASMN1; SMN2 | |
| SCHEMBL6574647 | 0.82 | PTGER1 (0.45) | PTPN11F2PRSS1PRSS2PRSS3 | |
| SCHEMBL6572502 | 0.81 | S100B (0.40) | KDM4EALDH1A1GAAMEN1KMT2A | |
| SCHEMBL6573203 | 0.81 | ALDH1A1 (0.34) | ALDH1A1GAAMEN1KMT2AF2 | |
| SCHEMBL6571532 | 0.80 | HTR7 (0.44) | MAPK1ALDH1A1POLBRAB9AMEN1 | |
| SCHEMBL6570863 | 0.80 | CRHR1 (0.39) | MAPK1ALDH1A1GAAMEN1KMT2A | |
| SCHEMBL6571801 | 0.79 | ALDH1A1 (0.37) | ALDH1A1GAAMEN1KMT2ASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1051143-B1 | OXIDIZING HAIR COLORING AGENTS CONTAINING 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES AND NOVEL 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES | WELLA AG (DE) | 2004-07-21 | — | — | EP | claimed |
| US-6500213-B1 | Oxidizing hair coloring agents containing 2,5-diamino-1-phenylbenzene derivatives and novel 2,5-diamino-1-phenylbenzene derivatives | WELLA AKTIENGESELLSCHAFT (DE) | 2002-12-31 | — | — | US | disclosed |