Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.44 |
| ▸ | SLC22A12 | Q96S37 | 10/20 | 0.41 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | ENPP3 | O14638 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27893618 | 0.83 | PARP1 (0.48) | PARP1MTNR1ASLC22A12SLC22A6ABCG2 | |
| SCHEMBL29831328 | 0.77 | PARP1 (0.59) | PARP1MTNR1ASLC22A12SLC22A6ABCG2 | |
| SCHEMBL8877952 | 0.77 | PARP1 (0.59) | PARP1MTNR1ASLC22A12SLC22A6ABCG2 | |
| SCHEMBL4709914 | 0.77 | NOTUM (0.44) | L3MBTL1 | |
| SCHEMBL15809211 | 0.76 | ELANE (0.44) | BRD4POLB | |
| SCHEMBL3592491 | 0.74 | MTNR1A (0.52) | PARP1MTNR1ASLC22A12 | |
| SCHEMBL3651898 | 0.72 | MAPT (0.38) | SLC22A12RAPGEF4 | |
| SCHEMBL4589677 | 0.72 | PARP1 (0.46) | PARP1MTNR1ASLC22A12SLC22A6ABCG2 | |
| SCHEMBL15221660 | 0.70 | KMT2A (0.46) | PARP1MTNR1AL3MBTL1 | |
| SCHEMBL21285519 | 0.70 | GPR119 (0.53) | POLB |
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-2155745-A1 | 6-(PYRROLOPYRIDINYL)-PYRIMIDINE-2-YL-AMINE DERIVATIVES | Merck Patent GmbH (DE) | 2010-02-24 | — | — | EP | disclosed |
| WO-2008155000-A1 | 6-(PYRROLOPYRIDINYL)-PYRIMIDINE-2-YL-AMINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2008-12-24 | — | — | WO | disclosed |