Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19965171 | 0.73 | BRAF (0.36) | ALDH1A1HPGD | |
| SCHEMBL5205678 | 0.69 | GRIN2D (0.53) | KDM4EMEN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL19965165 | 0.69 | HTT (0.40) | KDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL19965244 | 0.68 | ROCK1 (0.32) | — | |
| SCHEMBL19155132 | 0.67 | NPC1 (0.38) | MEN1ALDH1A1HPGDHTR2AHTR2C | |
| SCHEMBL29406937 | 0.67 | NPC1 (0.38) | MEN1ALDH1A1HPGDHTR2AHTR2C | |
| SCHEMBL27992493 | 0.66 | ALDH1A1 (0.36) | KDM4EMEN1ALDH1A1CYP3A4KMT2A | |
| SCHEMBL12813957 | 0.66 | ROCK1 (0.51) | KDM4EMEN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL19965080 | 0.65 | LMNA (0.38) | ALDH1A1 | |
| SCHEMBL19965160 | 0.65 | CYP1A2 (0.41) | CYP1A2HTR1ACYP2C9CYP2C19 |
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-2018049324-A1 | MONOCYCLIC COMPOUNDS USEFUL AS GPR120 MODULATORS | NUMERATE, INC. (US) | 2018-03-15 | — | — | WO | disclosed |