Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | NR2E1 | Q9Y466 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | HTR2B | P41595 | 3/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.36 |
| ▸ | HTR2A | P28223 | 3/20 | 0.36 |
| ▸ | HTR2C | P28335 | 3/20 | 0.36 |
| ▸ | HTR6 | P50406 | 3/20 | 0.36 |
| ▸ | SCN1A | P35498 | 2/20 | 0.36 |
| ▸ | SLC10A1 | Q14973 | 2/20 | 0.36 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13149057 | 0.90 | NR2E1 (0.41) | TSHRNR2E1ALDH1A1TDP1KDM4E | |
| SCHEMBL13077481 | 0.87 | NR2E1 (0.47) | TSHRNR2E1ALDH1A1TDP1KDM4E | |
| SCHEMBL13077524 | 0.86 | HTR1A (0.43) | TSHRALDH1A1KDM4ECYP2D6ADRB2 | |
| SCHEMBL13077340 | 0.84 | NR2E1 (0.39) | TSHRNR2E1ALDH1A1CYP2D6ADRB2 | |
| SCHEMBL13077341 | 0.83 | NR2E1 (0.56) | TSHRNR2E1ALDH1A1TDP1KDM4E | |
| SCHEMBL13077486 | 0.76 | NPY1R (0.38) | TDP1CYP2D6ADRB2ADRB1ADRB3 | |
| SCHEMBL13077699 | 0.75 | ADRB2 (0.49) | KDM4EADRB2ADRB1LMNASLC22A1 | |
| SCHEMBL13077519 | 0.75 | ADRB2 (0.43) | CYP2D6ADRB2ADRB1HTR2A | |
| SCHEMBL13077708 | 0.75 | ADRB2 (0.43) | ADRB2ADRB1ADRB3LMNAMAPK1 | |
| SCHEMBL13077336 | 0.74 | NR2E1 (0.48) | TSHRNR2E1ALDH1A1TDP1KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7825263-B2 | Nitrooxyderivatives of carvedilol and other beta blockers as antihypertensive | NICOX S.A. (FR) | 2010-11-02 | — | — | US | disclosed |