Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 5/20 | 0.55 |
| ▸ | ACVR1 | Q04771 | 8/20 | 0.44 |
| ▸ | HTR7 | P34969 | 3/20 | 0.44 |
| ▸ | TGFBR1 | P36897 | 4/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.40 |
| ▸ | HTR3B | O95264 | 2/20 | 0.40 |
| ▸ | HTR3A | P46098 | 2/20 | 0.40 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.40 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | HTR6 | P50406 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4573292 | 0.85 | ADRB1 (0.54) | ADRB1ACVR1HTR7TGFBR1USP2 | |
| SCHEMBL4573825 | 0.83 | ACVR1 (0.51) | ADRB1ACVR1HTR7TGFBR1HTR1A | |
| SCHEMBL14008974 | 0.81 | ADRB1 (0.67) | ADRB1HTR7ALDH1A1HTR1AHTR3E | |
| SCHEMBL4541552 | 0.79 | ADRB1 (0.50) | ADRB1ACVR1TGFBR1USP2ALDH1A1 | |
| SCHEMBL30798753 | 0.77 | ADRB1 (0.61) | ADRB1ACVR1HTR7TGFBR1USP2 | |
| SCHEMBL1741562 | 0.77 | ADRB1 (0.61) | ADRB1ACVR1HTR7TGFBR1USP2 | |
| SCHEMBL4573103 | 0.75 | ADRB1 (0.58) | ADRB1HTR7ALDH1A1HTR1AHTR3E | |
| SCHEMBL29138207 | 0.74 | ADRB1 (0.61) | ADRB1ACVR1HTR7TGFBR1USP2 | |
| SCHEMBL1422991 | 0.74 | ADRB1 (0.81) | ADRB1HTR7USP2ALDH1A1TSHR | |
| SCHEMBL27107055 | 0.73 | ADRB1 (0.63) | ADRB1ACVR1HTR7USP2ALDH1A1 |
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-2009001127-A1 | CYANOCYCLOPROPYLCARBOXAMIDES AS CATHEPSIN INHIBITORS | ASTRAZENECA AB (SE) | 2008-12-31 | — | — | WO | disclosed |