Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 5/20 | 0.33 |
| ▸ | PPARA | Q07869 | 5/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12433897 | 1.00 | SIGMAR1 (0.38) | SIGMAR1CYP1A2ALDH1A1THRBHPGD | |
| SCHEMBL18174836 | 0.99 | CYP1A2 (0.38) | SIGMAR1CYP1A2ALDH1A1THRBHPGD | |
| SCHEMBL17263999 | 0.96 | SIGMAR1 (0.38) | SIGMAR1CYP1A2ALDH1A1THRBHPGD | |
| SCHEMBL17263970 | 0.96 | SIGMAR1 (0.38) | SIGMAR1CYP1A2ALDH1A1THRBHPGD | |
| SCHEMBL22744779 | 0.95 | CYP1A2 (0.39) | SIGMAR1CYP1A2ALDH1A1THRBHPGD | |
| SCHEMBL10028985 | 0.93 | SIGMAR1 (0.38) | SIGMAR1CYP1A2ALDH1A1THRBHPGD | |
| SCHEMBL13899977 | 0.93 | SIGMAR1 (0.37) | SIGMAR1CYP1A2ALDH1A1THRBHPGD | |
| SCHEMBL13899984 | 0.93 | SIGMAR1 (0.38) | SIGMAR1CYP1A2CA12CA1CA2 | |
| SCHEMBL18174843 | 0.93 | CYP1A2 (0.40) | SIGMAR1CYP1A2ALDH1A1THRBHPGD | |
| SCHEMBL10028998 | 0.92 | SIGMAR1 (0.37) | SIGMAR1CYP1A2ALDH1A1THRBHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-7981523-B2 | Aromatic amine derivative and organic electroluminescence device using the same | IDEMITSU KOSAN CO., LTD. (JP) | 2011-07-19 | — | — | US | disclosed |
| US-7981523-B2 | Aromatic amine derivative and organic electroluminescence device using the same | IDEMITSU KOSAN CO., LTD. (JP) | 2011-07-19 | — | — | US | disclosed |