Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.55 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 7/20 | 0.48 |
| ▸ | HTR1A | P08908 | 4/20 | 0.47 |
| ▸ | DRD2 | P14416 | 3/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | AGXT | P21549 | 2/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29194803 | 0.82 | CYP1A1 (0.43) | CYP1A1CYP1A2CYP1B1ABCB1TAAR1 | |
| SCHEMBL6015558 | 0.82 | CYP1A2 (0.51) | NFE2L2CYP1A1CYP1A2CYP1B1IDO1 | |
| SCHEMBL27947937 | 0.79 | MAOB (0.53) | CYP1A2ABCB1HTR1ADRD2TAAR1 | |
| SCHEMBL5620883 | 0.76 | MAOB (0.54) | ABCB1HTR1ADRD2MAOB | |
| SCHEMBL8305017 | 0.76 | TAAR1 (0.58) | TAAR1IDO1AGXTMAOBSIGMAR1 | |
| SCHEMBL4949651 | 0.76 | RELA (0.54) | TAAR1IDO1AGXTMAOBSIGMAR1 | |
| SCHEMBL6991472 | 0.75 | NFE2L2 (0.58) | NFE2L2TAAR1IDO1AGXTMAOB | |
| SCHEMBL248658 | 0.74 | CHRM2 (0.57) | CYP1A2TAAR1IDO1AGXTMAOB | |
| SCHEMBL3503547 | 0.74 | TAAR1 (0.56) | TAAR1IDO1AGXTMAOBSIGMAR1 | |
| SCHEMBL8598224 | 0.74 | NQO2 (0.50) | CYP1A2TAAR1IDO1AGXTMAOB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996009823-A9 | HYPOGLYCEMIC AGENT FROM CRYPTOLEPIS | — | 1996-05-23 | — | — | WO | claimed |