Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | SYK | P43405 | 3/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.32 |
| ▸ | AXL | P30530 | 1/20 | 0.32 |
| ▸ | MERTK | Q12866 | 1/20 | 0.32 |
| ▸ | GBA1 | P04062 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4293441 | 0.90 | MAPK1 (0.47) | MAPK1KMT2APDCD1CD274ACHE | |
| SCHEMBL4291807 | 0.85 | KMT2A (0.48) | MAPK1KMT2AACHESYKS1PR1 | |
| SCHEMBL3399112 | 0.80 | KMT2A (0.47) | MAPK1KMT2APDCD1CD274ACHE | |
| SCHEMBL3401336 | 0.72 | MAPK1 (0.44) | MAPK1KMT2AACHECYP3A4MGLL | |
| SCHEMBL24566166 | 0.70 | NR1H2 (0.61) | KMT2AACHENR1H2ADORA2AADORA1 | |
| SCHEMBL3401846 | 0.69 | KMT2A (0.44) | MAPK1KMT2ACD274ACHECYP3A4 | |
| SCHEMBL3399585 | 0.69 | MAPK1 (0.46) | MAPK1KMT2APDCD1CD274ACHE | |
| SCHEMBL3397028 | 0.69 | KMT2A (0.46) | MAPK1KMT2AACHECYP3A4NR1H2 | |
| SCHEMBL3397026 | 0.69 | KMT2A (0.46) | MAPK1KMT2AACHECYP3A4NR1H2 | |
| SCHEMBL4296964 | 0.69 | ACHE (0.44) | PDCD1CD274ACHES1PR1CYP3A4 |
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 |