Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 8/20 | 0.41 |
| ▸ | ABCC1 | P33527 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL9803157 | 0.98 | KDM4E (0.47) | KCNH2KDM4EALDH1A1SMPD1TDP1 | |
| SCHEMBL9803767 | 0.91 | NR2F2 (0.41) | KDM4EALDH1A1CYP2D6ABCB1LMNA | |
| SCHEMBL9803091 | 0.89 | KDM4E (0.46) | KDM4ETDP1LMNAMAPTSMN1; SMN2 | |
| Oxalic Acid SCHEMBL9803165 | 0.87 | KDM4E (0.49) | KDM4EALDH1A1TDP1LMNAMEN1 | |
| SCHEMBL9803476 | 0.84 | OPRM1 (0.44) | KCNH2KDM4EALDH1A1TDP1CYP3A4 | |
| SCHEMBL7343184 | 0.83 | KCNH2 (0.49) | KCNH2KDM4EALDH1A1SMPD1CYP3A4 | |
| Hydrochloric Acid SCHEMBL9803523 | 0.83 | OPRM1 (0.43) | KCNH2KDM4EALDH1A1TDP1CYP3A4 | |
| SCHEMBL9803513 | 0.83 | MAPK14 (0.44) | KCNH2ALDH1A1CYP3A4CYP1A2CYP2D6 | |
| Oxalic Acid SCHEMBL9427500 | 0.81 | KDM4E (0.47) | KCNH2KDM4EALDH1A1SMPD1CYP3A4 | |
| SCHEMBL9803763 | 0.80 | KDM4E (0.45) | KDM4EALDH1A1MEN1KMT2AGAA |
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-5001159-A | Hypotensive, antiulcer, antiischemic agents; migraines, asthma epilepsy, anticoagulants; cardiovasculat disorders | SYNTHELABO (FR) | 1991-03-19 | — | — | US | claimed |