Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.54 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 2/20 | 0.53 |
| ▸ | HTR2C | P28335 | 2/20 | 0.53 |
| ▸ | HTR2B | P41595 | 2/20 | 0.53 |
| ▸ | PLA2G2A | P14555 | 3/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
| ▸ | DRD4 | P21917 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | THRA | P10827 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 2/20 | 0.49 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | HTR7 | P34969 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10901455 | 0.87 | S1PR1 (0.64) | S1PR1KDM4EGAAITGB3ITGA2B | |
| SCHEMBL10899661 | 0.84 | S1PR1 (0.56) | S1PR1KDM4EGAAHTR2AHTR2C | |
| SCHEMBL177063 | 0.82 | S1PR1 (1.00) | S1PR1KDM4EGAAHTR2AHTR2C | |
| SCHEMBL4187481 | 0.81 | KDM4E (0.65) | S1PR1KDM4EGAASIGMAR1KCNH2 | |
| SCHEMBL10901038 | 0.81 | KDM4E (0.65) | S1PR1KDM4EGAASIGMAR1KCNH2 | |
| SCHEMBL10902035 | 0.81 | KDM4E (0.68) | S1PR1KDM4EGAAHTR2APLA2G2A | |
| Hydrochloric Acid SCHEMBL10899527 | 0.80 | KDM4E (0.63) | S1PR1KDM4EGAAPLA2G2AKCNH2 | |
| SCHEMBL1280837 | 0.80 | KDM4E (0.62) | S1PR1KDM4EGAAHTR2ASIGMAR1 | |
| SCHEMBL15740778 | 0.79 | THRA (0.69) | KDM4EGAAHTR2ASIGMAR1THRA | |
| SCHEMBL10902141 | 0.79 | ALDH1A1 (0.62) | S1PR1PLA2G2ASIGMAR1KCNH2THRA |
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 |
|---|---|---|---|---|---|---|---|
| US-4616086-A | ANTICOAGULANTS | BOEHRINGER MANNHEIM GMBH (DE) | 1986-10-07 | — | — | US | disclosed |
| EP-0076996-A1 | Carboxylic-acid derivatives, process for their preparation and medicines containing them | Roche Diagnostics GmbH (DE) | 1983-04-20 | — | — | EP | disclosed |