Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.59 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 5/20 | 0.36 |
| ▸ | SMPD3 | Q9NY59 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.35 |
| ▸ | UBE2T | Q9NPD8 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL16416386 | 0.74 | PARP1 (1.00) | PARP1SMPD3 | |
| SCHEMBL16416586 | 0.73 | PARP1 (1.00) | PARP1SMPD3PIM1ALDH1A1MAPT | |
| SCHEMBL15651358 | 0.70 | PARP1 (0.50) | PARP1CNR1CYP1A2CHRM4UBE2T | |
| SCHEMBL17311170 | 0.67 | P2RX7 (0.57) | P2RX7ALDH1A1POLB | |
| SCHEMBL29767973 | 0.66 | SMN1; SMN2 (0.52) | PARP1ALDH1A1MAPTMAPK1POLB | |
| SCHEMBL26675390 | 0.66 | SMN1; SMN2 (0.52) | PARP1ALDH1A1MAPTMAPK1POLB | |
| SCHEMBL12168180 | 0.64 | PARP1 (0.44) | PARP1SMPD3CYP1A2PIM1PTGER1 | |
| SCHEMBL17310969 | 0.64 | P2RX7 (0.54) | P2RX7 | |
| SCHEMBL20998482 | 0.63 | PARP1 (0.50) | PARP1SMPD3UBE2TPTPN11ALDH1A1 | |
| SCHEMBL16416339 | 0.63 | PARP1 (1.00) | PARP1CYP1A2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015011008-A1 | 7-AZAINDOLE DERIVATIVES AS PARP INHIBITORS | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 2015-01-29 | — | — | WO | claimed |
| WO-2015011008-A1 | 7-AZAINDOLE DERIVATIVES AS PARP INHIBITORS | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 2015-01-29 | — | — | WO | disclosed |