Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | FDPS | P14324 | 1/20 | 0.45 |
| ▸ | MMP8 | P22894 | 1/20 | 0.45 |
| ▸ | MMP14 | P50281 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.43 |
| ▸ | F2R | P25116 | 1/20 | 0.42 |
| ▸ | PDE5A | O76074 | 1/20 | 0.41 |
| ▸ | CASR | P41180 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL30505169 | 0.89 | MAPT (0.50) | MGLLMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL14149699 | 0.89 | MAPT (0.50) | MGLLMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11621865 | 0.86 | PRMT6 (0.49) | MAPTCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL13996647 | 0.84 | MGLL (0.50) | MGLLMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5646277 | 0.83 | KIF11 (0.58) | MGLLCYP1A2ALDH1A1KMT2APOLB | |
| SCHEMBL16882734 | 0.82 | ADRB2 (0.54) | F2RKMT2A | |
| SCHEMBL8260133 | 0.82 | ALDH1A1 (0.48) | MAPTHTTALDH1A1PDE5AKMT2A | |
| SCHEMBL7745902 | 0.81 | MTNR1B (0.52) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL52481 | 0.81 | MAPT (0.64) | MAPTCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8493642 | 0.81 | MAPT (0.61) | MAPTCYP1A2CYP3A4CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-6713514-B1 | SUCH AS 2-(BENZYLAMINO)-3-(4-(N-(3-PHENYLPROPYL)CARBAMOYL)-PHENYL)PROPANOIC ACID | LEXICON PHARMACEUTICALS, INC. | 2004-03-30 | — | — | US | disclosed |