Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | RORC | P51449 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 5/20 | 0.46 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.44 |
| ▸ | RORA | P35398 | 1/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.44 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.44 |
| ▸ | RORB | Q92753 | 1/20 | 0.44 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9073588 | 0.79 | C5AR1 (0.56) | KMT2ALMNANR1H2NR1H3MEN1 | |
| SCHEMBL28669397 | 0.77 | ACHE (0.48) | TSHRMAPK1KMT2AHSD17B10RORC | |
| SCHEMBL6428043 | 0.71 | ESR1 (0.77) | TSHRMAPK1KMT2AHSD17B10RORC | |
| SCHEMBL6301809 | 0.71 | ESR1 (0.60) | TSHRMAPK1KMT2AHSD17B10RORC | |
| SCHEMBL10979953 | 0.70 | CYP2C9 (0.51) | TSHRMAPK1KMT2AHSD17B10RORC | |
| SCHEMBL28133849 | 0.69 | CNR1 (0.69) | TSHRMAPK1KMT2AHSD17B10RORC | |
| SCHEMBL6297282 | 0.68 | ESR1 (0.70) | TSHRMAPK1KMT2AHSD17B10RORC | |
| SCHEMBL17174234 | 0.68 | PSEN1 (0.57) | TSHRMAPK1KMT2AHSD17B10ESR1 | |
| SCHEMBL12482378 | 0.68 | C5AR1 (0.53) | KMT2AESR1CNR1CNR2KEAP1 | |
| SCHEMBL5604160 | 0.66 | ESR1 (0.73) | TSHRMAPK1KMT2AHSD17B10ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5542953-A | COUPLERS WITH IMPROVED WATER SOLUBILITY, SHELF STABILITY; COLORFAST HAIR DYES WITH VARIETY OF SHADES | WELLA AG (DE) | 1996-08-06 | — | — | US | disclosed |
| EP-0583435-B1 | AGENT FOR THE OXIDATIVE COLOURING OF HAIR AND NOVEL 5-HALOGEN-2,4-BIS(ALKYLAMINO)-1-ALKYLBENZENES | WELLA AG (DE) | 1995-08-23 | — | — | EP | disclosed |
| EP-0583435-A1 | AGENT FOR THE OXIDATIVE COLOURING OF HAIR AND NOVEL 5-HALOGEN-2,4-BIS(ALKYLAMINO)-1-ALKYLBENZOLS. | WELLA AG (DE) | 1994-02-23 | — | — | EP | disclosed |
| WO-1993016677-A1 | AGENT FOR THE OXIDATIVE COLOURING OF HAIR AND NOVEL 5-HALOGEN-2,4-BIS(ALKYLAMINO)-1-ALKYLBENZOLS | WELLA AKTIENGESELLSCHAFT (DE) | 1993-09-02 | — | — | WO | disclosed |