Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 4/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 3/20 | 0.46 |
| ▸ | CNR2 | P34972 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3005616 | 0.86 | CCR2 (0.62) | CCR2CYP1A2KDM4EMEN1CYP3A4 | |
| SCHEMBL2814057 | 0.84 | SMN1; SMN2 (0.54) | CYP1A2KDM4EMEN1CYP3A4CYP2D6 | |
| SCHEMBL3757847 | 0.80 | GPR35 (0.48) | CCR2CYP1A2KDM4EMEN1CYP3A4 | |
| SCHEMBL2049484 | 0.80 | CNR2 (0.46) | CYP1A2KDM4EMEN1CYP3A4CYP2D6 | |
| SCHEMBL1422436 | 0.80 | CCR2 (0.74) | CCR2CYP1A2POLBALDH1A1MCL1 | |
| SCHEMBL298062 | 0.78 | CCR2 (0.52) | CCR2CYP1A2KDM4EMEN1CYP3A4 | |
| SCHEMBL2815078 | 0.77 | ATM (0.62) | CCR2CYP1A2KDM4EMEN1CYP3A4 | |
| SCHEMBL3009191 | 0.76 | GPR35 (0.44) | CCR2CYP1A2KDM4EMEN1CYP3A4 | |
| SCHEMBL2811264 | 0.76 | ECE1 (0.53) | CYP1A2KDM4EMEN1CYP3A4CYP2D6 | |
| SCHEMBL23269095 | 0.76 | CYP1A2 (0.76) | CYP1A2KDM4EMEN1CYP3A4CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101247808-B | N- (arylalkyl) -1H-pyrrolopyridine-2-carboxamide derivatives and their preparation | SANOFI AVENTIS | 2014-08-27 | — | — | CN | disclosed |
| EP-1912644-B1 | N-(ARYLALKYL)-1H-PYRROLOPYRIDINE-2-CARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF | SANOFI AVENTIS (FR) | 2009-12-16 | — | — | EP | disclosed |
| CN-101247808-A | N- (arylalkyl) -1H-pyrrolopyridine-2-carboxamide derivatives, their preparation and their therapeutic use | SANOFI AVENTIS (FR) | 2008-08-20 | — | — | CN | disclosed |