Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.47 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.47 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.47 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6314811 | 0.84 | GAA (0.51) | TSHRCYP3A4PDK1PDK2PDK3 | |
| SCHEMBL2979786 | 0.83 | CYP1A2 (0.55) | CYP1A2TNIKL3MBTL1SMN1; SMN2LMNA | |
| SCHEMBL3543982 | 0.81 | ALDH1A1 (0.43) | TSHRPDK1PDK2PDK3PDK4 | |
| SCHEMBL3251775 | 0.81 | PDK1 (0.43) | TSHRPDK1PDK2PDK3PDK4 | |
| SCHEMBL2709623 | 0.81 | PDK1 (0.44) | TSHRPDK1PDK2PDK3PDK4 | |
| SCHEMBL13872957 | 0.80 | L3MBTL1 (0.47) | PDK1PDK2PDK3PDK4CYP1A2 | |
| SCHEMBL4286209 | 0.80 | TSHR (0.55) | TSHRCYP3A4RECQLSMN1; SMN2LMNA | |
| SCHEMBL15998606 | 0.79 | PDK1 (0.43) | TSHRCYP3A4PDK1PDK2PDK3 | |
| SCHEMBL14409902 | 0.79 | GAA (0.51) | TSHRCYP1A2LMNAHTTCYP2C9 | |
| SCHEMBL20749949 | 0.79 | POLB (0.46) | TSHRCYP3A4PDK1PDK2PDK3 |
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-0269914-B1 | COMPOSITION AND PROCESS FOR THE OXIDATIVE DYEING OF HAIR ON THE BASIS OF 3-(2',2',2'-TRIFLUORETHYL)AMINOPHENOL DERIVATIVES, AND 3-(2',2',2'-TRIFLUORETHYL)AMINOPHENOL DERIVATIVES | Wella Aktiengesellschaft (DE) | 1991-06-12 | — | — | EP | disclosed |
| WO-1988004166-A1 | HAIR DYEING OXIDISING AGENT AND PROCESS WITH 3-(2',2',2'-TRIFLUOROETHYL)AMINO-PHENOL DERIVATES AND NEW 3-(2',2',2'-TRIFLUOROETHYL)AMINO-PHENOL DERIVATES | WELLA AKTIENGESELLSCHAFT (DE) | 1988-06-16 | — | — | WO | disclosed |