Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | ACLY | P53396 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL8611709 | 0.93 | PTGS2 (0.44) | PTGS2ACLYGABRA1GABRG2GABRB3 | |
| SCHEMBL8607613 | 0.90 | SLC9A1 (0.46) | PTGS2CNR1CNR2KDM4EAGTR1 | |
| SCHEMBL8611119 | 0.90 | CA2 (0.48) | CNR1CNR2ACLYGABRA1GABRG2 | |
| SCHEMBL8608965 | 0.89 | PTGS2 (0.47) | PTGS2ACLYGABRA1GABRG2GABRB3 | |
| SCHEMBL8608217 | 0.82 | CA2 (0.50) | PTGS2ACLYGABRA1GABRG2GABRB3 | |
| SCHEMBL8611178 | 0.82 | SLC9A1 (0.47) | PTGS2CNR1CNR2KDM4E | |
| SCHEMBL8534933 | 0.81 | SLC9A1 (0.55) | — | |
| SCHEMBL8580858 | 0.80 | CNR2 (0.37) | CNR2GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL8608336 | 0.80 | CA2 (0.41) | PTGS2CNR1CNR2CA1CA2 | |
| SCHEMBL8580364 | 0.79 | CNR2 (0.37) | CNR2KDM4EHPGDCA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5807896-A | Arylbenzoylguanidines | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTING (DE) | 1998-09-15 | — | — | US | disclosed |