Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 6/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | G6PD | P11413 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2100657 | 0.85 | TSHR (0.55) | TSHRALDH1A1CYP3A4CYP1A2RECQL | |
| SCHEMBL19230478 | 0.83 | CYP1A2 (0.60) | TSHRALDH1A1CYP3A4CYP1A2RECQL | |
| SCHEMBL30855983 | 0.80 | CYP1A2 (0.67) | TSHRALDH1A1CYP3A4CYP1A2RECQL | |
| SCHEMBL19501351 | 0.78 | TSHR (0.48) | TSHRALDH1A1CYP3A4CYP1A2RECQL | |
| SCHEMBL4349338 | 0.78 | TSHR (0.48) | TSHRALDH1A1CYP3A4CYP1A2RECQL | |
| SCHEMBL249035 | 0.77 | CTSB (0.60) | TSHRALDH1A1CYP3A4RECQLTDP1 | |
| SCHEMBL5203487 | 0.76 | CYP1A2 (0.52) | TSHRALDH1A1CYP3A4CYP1A2RECQL | |
| SCHEMBL30237358 | 0.76 | TSHR (0.47) | TSHRALDH1A1CYP3A4CYP1A2RECQL | |
| SCHEMBL6671674 | 0.76 | CYP1A2 (0.52) | TSHRALDH1A1CYP3A4CYP1A2RECQL | |
| SCHEMBL3459834 | 0.76 | GPR35 (0.48) | TSHRALDH1A1CYP3A4CYP1A2RECQL |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4736067-A | DIRECT AND OXIDATION HAIR DYES | L'OREAL (FR) | 1988-04-05 | — | — | US | claimed |
| EP-0145513-B1 | DERIVATIVES OF DIMETHYL-3-NITRO-4-AMINO-ANILINE, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THE DYEING OF KERATIN FIBRES | L'OREAL (FR) | 1988-03-23 | — | — | EP | claimed |
| CN-113861216-B | Compound containing pyrimidine heterocyclic structure and preparation method and application thereof | 潍坊医学院 | 2022-12-09 | — | — | CN | disclosed |
| CN-113861216-A | Compound containing pyrimidine heterocyclic structure and preparation method and application thereof | 潍坊医学院 | 2021-12-31 | — | — | CN | disclosed |
| US-20120141398-A1 | HAIR DYE CONTAINING ONE OR MORE EDIBLE OR COSMETIC COLORS | CHUANG KUO SHENG (TW) | 2012-06-07 | — | — | US | disclosed |
| US-4736067-A | DIRECT AND OXIDATION HAIR DYES | L'OREAL (FR) | 1988-04-05 | — | — | US | disclosed |