Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 3/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | RET | P07949 | 1/20 | 0.35 |
| ▸ | CLK2 | P49760 | 2/20 | 0.33 |
| ▸ | CLK3 | P49761 | 2/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | MAPK7 | Q13164 | 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 | |
|---|---|---|---|---|
| SCHEMBL3402097 | 0.82 | ROCK2 (0.38) | ROCK2OPRM1OPRL1HRH4RET | |
| SCHEMBL4288228 | 0.70 | GRIN2D (0.45) | ROCK2HRH4GRIN2DGRIN3BCHRM1 | |
| SCHEMBL31713196 | 0.66 | ALDH1A1 (0.53) | ROCK2CHRNB2CHRNA4ROCK1CDC42BPB | |
| SCHEMBL31713794 | 0.66 | PLD1 (0.58) | GRIN2DGRIN3BGRIN1GRIN2AGRIN2B | |
| SCHEMBL31713285 | 0.65 | CHRNB2 (0.49) | ROCK2OPRM1OPRL1CHRNB2CHRNA4 | |
| SCHEMBL31713149 | 0.65 | ROCK2 (0.46) | ROCK2OPRM1OPRL1CHRNB2CHRNA4 | |
| SCHEMBL9989365 | 0.65 | GRIN2D (0.61) | HRH4GRIN2DGRIN3BCHRM1ADRA1D | |
| SCHEMBL3505596 | 0.64 | HRH4 (0.59) | HRH4GRIN2DGRIN3BCHRM1ADRA1D | |
| SCHEMBL31713596 | 0.64 | RET (0.42) | ROCK2OPRM1OPRL1RETCHRNB2 | |
| SCHEMBL25525700 | 0.63 | HRH4 (0.67) | HRH4DYRK1AGRIN2DGRIN3BCHRM1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2247591-A1 | PYRROLO [2, 3-D]PYRIDINES AND USE THEREOF AS TYROSINE KINASE INHIBITORS | Novartis AG (CH) | 2010-11-10 | — | — | EP | disclosed |
| WO-2009098236-A1 | PYRROLO [2, 3-D] PYRIDINES AND USE THEREOF AS TYROSINE KINASE INHIBITORS | NOVARTIS AG (CH) | 2009-08-13 | — | — | WO | disclosed |