Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 3/20 | 0.51 |
| ▸ | NMT2 | O60551 | 2/20 | 0.51 |
| ▸ | NMT1 | P30419 | 2/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | NOS2 | P35228 | 2/20 | 0.44 |
| ▸ | CDK4 | P11802 | 1/20 | 0.43 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.43 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.43 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.42 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.42 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.42 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.42 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.42 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.42 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1542815 | 0.91 | HCAR3 (0.61) | HCAR3ALOX15TRPV4RAB9AKDM4E | |
| SCHEMBL4233677 | 0.87 | HCAR3 (0.56) | HCAR3KDM4ECDK4PRKAB2PRKAG1 | |
| SCHEMBL4217728 | 0.86 | HCAR3 (0.48) | HCAR3NMT2NMT1ALOX15TRPV4 | |
| SCHEMBL17830863 | 0.85 | HDAC1 (0.44) | NMT2NMT1ALOX15RAB9AMAPT | |
| SCHEMBL12893939 | 0.82 | RAB9A (0.57) | ALOX15RAB9ANPC1MAPT | |
| SCHEMBL4231706 | 0.80 | P2RY12 (0.47) | HCAR3TRPV4RAB9AKDM4ENPC1 | |
| SCHEMBL12277201 | 0.80 | HCAR3 (0.79) | HCAR3PRKAB2PRKAG1PRKAA2PRKAA1 | |
| Hydrochloric Acid SCHEMBL28763502 | 0.79 | CA12 (0.47) | NMT2NMT1RAB9ANPC1MAPT | |
| Hydrochloric Acid SCHEMBL28763503 | 0.79 | CA12 (0.47) | NMT2NMT1RAB9ANPC1MAPT | |
| SCHEMBL1938176 | 0.79 | HCAR3 (0.59) | HCAR3HRH3TDO2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1214313-A2 | HETEROARYLOXY PROPANOLAMINES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | SANOFI-SYNTHELABO (FR) | 2002-06-19 | — | — | EP | disclosed |
| WO-2001017989-A2 | HETEROARYLOXYPROPANOLAMINES AS BETA3-ADRENERGIC RECEPTOR AGONISTS | SANOFI-SYNTHELABO (FR) | 2001-03-15 | — | — | WO | disclosed |