Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 11/20 | 0.70 |
| ▸ | ADRB1 | P08588 | 8/20 | 0.70 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.70 |
| ▸ | HTR1A | P08908 | 3/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.70 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.70 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.70 |
| ▸ | LMNA | P02545 | 2/20 | 0.70 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.70 |
| ▸ | HTR2A | P28223 | 1/20 | 0.70 |
| ▸ | MAPT | P10636 | 1/20 | 0.64 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.61 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.61 |
| ▸ | MAOA | P21397 | 1/20 | 0.61 |
| ▸ | HTR2B | P41595 | 1/20 | 0.61 |
| ▸ | ADRB3 | P13945 | 5/20 | 0.58 |
| ▸ | USP2 | O75604 | 1/20 | 0.57 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | DRD1 | P21728 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL11870445 | 0.89 | MAPT (0.78) | ADRB2ADRB1CYP2D6HTR1ACYP1A2 | |
| SCHEMBL11135761 | 0.87 | ADRB2 (0.64) | ADRB2ADRB1CYP2D6HTR1ACYP1A2 | |
| Hydrochloric Acid SCHEMBL11870616 | 0.87 | MAPT (0.81) | ADRB2ADRB1CYP2D6HTR1ACYP1A2 | |
| SCHEMBL7310963 | 0.85 | MAPT (0.56) | ADRB2ADRB1CYP2D6HTR1ACYP1A2 | |
| SCHEMBL11845793 | 0.84 | ALDH1A1 (0.74) | ADRB2ADRB1CYP2D6HTR1ACYP1A2 | |
| SCHEMBL11860104 | 0.83 | ADRB2 (0.75) | ADRB2ADRB1CYP2D6HTR1ACYP1A2 | |
| Hydrochloric Acid SCHEMBL11226416 | 0.83 | ALDH1A1 (0.73) | ADRB2ADRB1CYP2D6HTR1ACYP1A2 | |
| SCHEMBL7308129 | 0.82 | MAPT (0.53) | ADRB2ADRB1CYP2D6HTR1ACYP1A2 | |
| Oxprenolol SCHEMBL16311 | 0.82 | ADRB2 (1.00) | ADRB2ADRB1CYP2D6HTR1ACYP1A2 | |
| Oxprenolol SCHEMBL16310 | 0.82 | ADRB2 (1.00) | ADRB2ADRB1CYP2D6HTR1ACYP1A2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4391980-A | FOR INVERSION OF CONFIGURATION OF OPTICALLY ACTIVE COMPOUNDS | CIBA-GEIGY CORPORATION (US) | 1983-07-05 | — | — | US | disclosed |
| US-4294966-A | SALT FORMATION | CIBA-GEIGY CORPORATION (US) | 1981-10-13 | — | — | US | disclosed |
| EP-0007605-A1 | A process for inverting the configuration in optically active compounds and optically active intermediate compounds and their salts required therefor | CIBA-GEIGY AG (CH) | 1980-02-06 | — | — | EP | disclosed |
| US-4161530-A | CYCLIC SUBSTITUTED AMINO ALCOHOL BETA-RECEPTOR-BLOCKING AGENT AND TRYPTOPHANE | CIBA-GEIGY CORPORATION (US) | 1979-07-17 | — | — | US | disclosed |
| US-3937834-A | ALPHA-RECEPTOR BLOCKER, BETA-RECEPTOR BLOCKER, HIGH BLOOD PRESSURE, ANGINA PECTORIS | CIBA-GEIGY CORPORATION (US) | 1976-02-10 | — | — | US | disclosed |