Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 5/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.45 |
| ▸ | CASR | P41180 | 3/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | HTR2C | P28335 | 2/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.45 |
| ▸ | DRD3 | P35462 | 2/20 | 0.45 |
| ▸ | MLNR | O43193 | 1/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL15211048 | 0.77 | TSHR (0.55) | CYP2C9ALDH1A1CYP1A2CYP2C19ADRA2C | |
| SCHEMBL2127427 | 0.77 | TSHR (0.55) | CYP2C9ALDH1A1CYP1A2CYP2C19ADRA2C | |
| SCHEMBL28422249 | 0.76 | HTR2A (0.51) | CYP2C9ALDH1A1CYP1A2CYP2C19ADRA2C | |
| SCHEMBL3412393 | 0.76 | CYP1A2 (0.50) | CYP2C9ALDH1A1CYP1A2CYP2C19ADRA2C | |
| SCHEMBL29484444 | 0.76 | HTR2A (0.51) | CYP2C9ALDH1A1CYP1A2CYP2C19ADRA2C | |
| SCHEMBL29110837 | 0.76 | ALDH1A1 (0.50) | CYP2C9ALDH1A1CYP1A2CYP2C19ADRA2C | |
| SCHEMBL3412391 | 0.76 | ALDH1A1 (0.50) | CYP2C9ALDH1A1CYP1A2CYP2C19ADRA2C | |
| SCHEMBL3410469 | 0.76 | ALDH1A1 (0.50) | CYP2C9ALDH1A1CYP1A2CYP2C19ADRA2C | |
| SCHEMBL3410473 | 0.76 | ALDH1A1 (0.50) | CYP2C9ALDH1A1CYP1A2CYP2C19ADRA2C | |
| SCHEMBL264495 | 0.76 | ALDH1A1 (0.50) | CYP2C9ALDH1A1CYP1A2CYP2C19ADRA2C |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4956390-A | FOR CARRYING GASES IN ARTIFICIAL BLOOD | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1990-09-11 | — | — | US | disclosed |
| US-4925992-A | VAPOR PHASE SOLDERING FLUID | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1990-05-15 | — | — | US | disclosed |
| US-4901910-A | FOR HEATING AND MELTING | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1990-02-20 | — | — | US | disclosed |
| US-4885414-A | OF DECAHYDRONAPHTHALENE; NONTOXIC, SHARP BOILING POINT; VAPOR PHASE SOLDERING, ELECTRONICS | UNIVERSITY OF PENNSYLVANIA | 1989-12-05 | — | — | US | disclosed |
| US-4881682-A | Vapor phase soldering with perfluorinated butyl derivative compounds | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1989-11-21 | — | — | US | disclosed |
| US-4873315-A | OF DECAHYDRONAPHTHALENE; ELECTRONICS, SYNTHETIC BLOOD, DIAGNOS TIC FLUIDS | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1989-10-10 | — | — | US | disclosed |
| US-4849553-A | SOLDERING, HYDRAULIC FLUIDS, HEAT TRANSFER | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1989-07-18 | — | — | US | disclosed |
| US-4396785-A | DIELECTRICS, ALKYLATION | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1983-08-02 | — | — | US | disclosed |