Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | MAOA | P21397 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MPO | P05164 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1106938 | 0.82 | MAOA (0.67) | ALDH1A1MAOAMAOBPTGS2TP53 | |
| SCHEMBL8380943 | 0.81 | GAA (0.53) | ALDH1A1CYP1A2CYP3A4CYP2C19GAA | |
| Bromide SCHEMBL7372571 | 0.81 | MAOA (0.65) | ALDH1A1MAOAMAOBPTGS2TP53 | |
| SCHEMBL27877527 | 0.80 | MEN1 (0.62) | ALDH1A1TP53CYP1A2CYP3A4LMNA | |
| SCHEMBL28116874 | 0.78 | HCAR2 (0.42) | ALDH1A1KDM4ECYP1A2CYP3A4MEN1 | |
| SCHEMBL23303748 | 0.76 | TAS1R3 (0.60) | ALDH1A1MAOAMAOBPTGS2TP53 | |
| SCHEMBL15706705 | 0.76 | TAS1R3 (0.60) | ALDH1A1MAOAMAOBPTGS2TP53 | |
| SCHEMBL6030061 | 0.76 | MAOA (0.58) | ALDH1A1MAOAMAOBPTGS2TP53 | |
| SCHEMBL21950435 | 0.76 | MAOA (0.58) | ALDH1A1MAOAMAOBPTGS2TP53 | |
| SCHEMBL29788361 | 0.75 | CYP26A1 (0.49) | ALDH1A1MAOAMAOBPTGS2TP53 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105073729-A | Phenyl-linked quinolinyl modulators of ROR γ t | JANSSEN PHARMACEUTICA NV | 2015-11-18 | — | — | CN | disclosed |
| CN-104910148-A | Aminotriazolopyridines and use thereof as kinase inhibitors | SIGNAL PHARM LLC | 2015-09-16 | — | — | CN | disclosed |
| CN-102203093-B | Aminotriazolopyridines and their use as kinase inhibitors | SIGNAL PHARM LLC | 2015-05-13 | — | — | CN | disclosed |
| CN-102203093-A | Aminotriazolopyridines and their use as kinase inhibitors | SIGNAL PHARM LLC | 2011-09-28 | — | — | CN | disclosed |