Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.42 |
| ▸ | AHR | P35869 | 2/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | METAP2 | P50579 | 1/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11161856 | 0.81 | CYP19A1 (0.47) | CYP19A1CYP2A6AHRNR4A2NOS1 | |
| SCHEMBL4273824 | 0.81 | CYP2A6 (0.58) | CYP19A1CYP2A6AHRNR4A2NOS1 | |
| SCHEMBL17422778 | 0.78 | CYP19A1 (0.45) | CYP19A1CYP2A6AHRNR4A2FLT3 | |
| SCHEMBL17422776 | 0.78 | CYP19A1 (0.45) | CYP19A1CYP2A6AHRNR4A2FLT3 | |
| SCHEMBL24492753 | 0.77 | LOXL2 (0.49) | CYP2A6FLT3HRH4KMT2AMEN1 | |
| SCHEMBL20853164 | 0.77 | KDM4E (0.47) | CYP2A6AHRMETAP2FLT3HRH4 | |
| SCHEMBL27145199 | 0.77 | CYP19A1 (0.44) | CYP19A1CYP2A6AHRNR4A2FLT3 | |
| SCHEMBL27145202 | 0.77 | CYP19A1 (0.44) | CYP19A1CYP2A6AHRNR4A2FLT3 | |
| SCHEMBL11167972 | 0.74 | CYP19A1 (0.52) | CYP19A1CYP2A6AHRNR4A2NOS1 | |
| SCHEMBL29396424 | 0.74 | CYP2A6 (0.64) | CYP2A6FLT3HSD17B10IDO1 |
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-2019077631-A1 | IMIDAZO-PYRIDINE COMPOUNDS AS PAD INHIBITORS | JUBILANT BIOSYS LIMITED (IN) | 2019-04-25 | — | — | WO | disclosed |