Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 12/20 | 0.61 |
| ▸ | ADRB3 | P13945 | 6/20 | 0.61 |
| ▸ | ADRB2 | P07550 | 6/20 | 0.61 |
| ▸ | ADRB1 | P08588 | 6/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | USP2 | O75604 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | THRB | P10828 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | GLA | P06280 | 1/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.61 |
| ▸ | DRD4 | P21917 | 1/20 | 0.61 |
| ▸ | HTR1B | P28222 | 1/20 | 0.61 |
| ▸ | HTR2C | P28335 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL7296273 | 0.86 | ADRB3 (0.67) | HTR1AADRB3ADRB2ADRB1CYP1A2 | |
| SCHEMBL7285328 | 0.86 | ADRB3 (0.67) | HTR1AADRB3ADRB2ADRB1CYP1A2 | |
| SCHEMBL7297780 | 0.85 | ADRB3 (0.68) | HTR1AADRB3ADRB2ADRB1CYP1A2 | |
| SCHEMBL6056296 | 0.84 | HTR1A (0.71) | HTR1AADRB3ADRB2ADRB1CYP1A2 | |
| SCHEMBL7288262 | 0.83 | ADRB3 (0.69) | HTR1AADRB3ADRB2ADRB1CYP1A2 | |
| SCHEMBL7296138 | 0.81 | ADRB3 (0.78) | ADRB3ADRB2ADRB1 | |
| SCHEMBL11226972 | 0.81 | HTR1A (0.65) | HTR1AADRB3ADRB2ADRB1CYP1A2 | |
| SCHEMBL4845543 | 0.80 | HTR1A (0.76) | HTR1AADRB3ADRB2ADRB1CYP1A2 | |
| SCHEMBL7876400 | 0.79 | HTR1A (0.54) | HTR1AADRB3ADRB2ADRB1CYP1A2 | |
| SCHEMBL16549970 | 0.78 | ADRB2 (0.70) | HTR1AADRB3ADRB2ADRB1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1994002463-A1 | ANTIHYPERTENSIVE 1,4-DIHYDROPYRIDINE DERIVATIVES AND PROCESS FOR THEIR PREPARATION | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1994-02-03 | — | — | WO | disclosed |