Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | PRNP | P04156 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6085259 | 1.00 | ALDH1A1 (0.33) | ALDH1A1TSHRMEN1PRNPMAPK10 | |
| SCHEMBL6085264 | 1.00 | ALDH1A1 (0.33) | ALDH1A1TSHRMEN1PRNPMAPK10 | |
| SCHEMBL418068 | 0.81 | GAA (0.41) | ALDH1A1TSHRNPSR1RXFP1HSD17B10 | |
| SCHEMBL9308973 | 0.81 | GAA (0.41) | ALDH1A1TSHRNPSR1RXFP1HSD17B10 | |
| SCHEMBL418070 | 0.81 | GAA (0.41) | ALDH1A1TSHRNPSR1RXFP1HSD17B10 | |
| SCHEMBL13198671 | 0.81 | GAA (0.41) | ALDH1A1TSHRNPSR1RXFP1HSD17B10 | |
| SCHEMBL8246813 | 0.81 | GAA (0.41) | ALDH1A1TSHRNPSR1RXFP1HSD17B10 | |
| SCHEMBL15188991 | 0.77 | GRM4 (0.35) | ALDH1A1TSHRMEN1PRNPMAPK10 | |
| SCHEMBL8226501 | 0.75 | — | — | |
| SCHEMBL9201745 | 0.75 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7019149-B2 | Thromboxane ligands without blood clotting side effects | ALLERGAN, INC. (US) | 2006-03-28 | — | — | US | disclosed |
| US-6818779-B2 | TREATING OCULAR HYPOTENSION, HYPERTENSION, HEMORRHAGE, MYOCARDIAL ISCHEMIA, ANGINA PECTORIS, CORONARY CONTRACTION, CEREBROVASCULAR CONTRACTION AFTER SUBARACHNOIDAL HEMORRHAGE, CEREBRAL HEMORRHAGE AND ASTHMA WHICH COMPRISES ADMINISTERING | ALLERGAN, INC. | 2004-11-16 | — | — | US | disclosed |
| US-6462077-B1 | OXABICYLCO COMPOUNDS; OCULAR HYPOTENSION, HYPERTENSION, HEMORRHAGE, MYOCARDIAL ISCHEMIA, ANGINA PECTORIS, CORONARY CONTRACTION, CEREBROVASCULAR CONTRACTION AFTER SUBARACH-NOIDAL HEMORRHAGE, CEREBRAL HEMORRHAGE, ASTHMA | ALLERGAN, INC. | 2002-10-08 | — | — | US | disclosed |