Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 7/20 | 0.46 |
| ▸ | ABL1 | P00519 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 5/20 | 0.44 |
| ▸ | RAB9A | P51151 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3254695 | 0.88 | ABL1 (0.46) | PARP1ABL1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3253872 | 0.85 | PARP1 (0.41) | PARP1ABL1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3246159 | 0.85 | PARP1 (0.47) | PARP1NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL3251225 | 0.85 | CSNK2A1 (0.42) | PARP1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL3252051 | 0.85 | PARP1 (0.41) | PARP1NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL3243014 | 0.84 | PARP1 (0.45) | PARP1RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL3254676 | 0.84 | ALDH1A1 (0.48) | PARP1ABL1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3251324 | 0.84 | BAZ2A (0.42) | PARP1 | |
| SCHEMBL3252671 | 0.83 | ALOX5 (0.42) | PARP1ABL1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL3251023 | 0.82 | CDC25A (0.43) | PARP1NPC1RAB9ASMN1; SMN2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1899335-B1 | PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS | PF MEDICAMENT (FR) | 2010-05-19 | — | — | EP | claimed |