Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.57 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | FABP4 | P15090 | 3/20 | 0.39 |
| ▸ | CXCR5 | P32302 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.37 |
| ▸ | BAD | Q92934 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7322972 | 0.98 | PARP1 (0.58) | PARP1GFERRORCFABP4CXCR5 | |
| SCHEMBL30251654 | 0.93 | PARP1 (0.60) | PARP1GFERRORCCXCR5KDM4E | |
| SCHEMBL984448 | 0.93 | PARP1 (0.60) | PARP1GFERRORCCXCR5KDM4E | |
| SCHEMBL729580 | 0.86 | PARP1 (0.74) | PARP1RORCFABP4ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7265489 | 0.85 | PARP1 (0.72) | PARP1RORCFABP4ALDH1A1 | |
| SCHEMBL17978285 | 0.79 | PARP1 (0.84) | PARP1 | |
| SCHEMBL18665581 | 0.79 | PARP1 (0.58) | PARP1KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL17978158 | 0.77 | PARP1 (0.81) | PARP1 | |
| SCHEMBL19584798 | 0.76 | GFER (0.40) | PARP1GFERFABP4CXCR5KDM4E | |
| SCHEMBL5755502 | 0.75 | CXCR5 (0.55) | GFERFABP4CXCR5ALDH1A1BCL2L1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992009284-A1 | 2,6-METHANO-2H-1-BENZOXOCINCARBOXAMIDES AS 5-HT3-ANTAGONISTS | RHONE-POULENC RORER INTERNATIONAL (HOLDINGS), INC. (US) | 1992-06-11 | — | — | WO | disclosed |