Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 4/20 | 0.59 |
| ▸ | HTR1A | P08908 | 3/20 | 0.56 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.56 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.56 |
| ▸ | HTR2C | P28335 | 7/20 | 0.53 |
| ▸ | HTR2A | P28223 | 3/20 | 0.50 |
| ▸ | HTR6 | P50406 | 3/20 | 0.50 |
| ▸ | HTR7 | P34969 | 2/20 | 0.50 |
| ▸ | HTR5A | P47898 | 2/20 | 0.50 |
| ▸ | DRD2 | P14416 | 2/20 | 0.50 |
| ▸ | DRD3 | P35462 | 2/20 | 0.50 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.50 |
| ▸ | HTR3B | O95264 | 2/20 | 0.50 |
| ▸ | HTR3A | P46098 | 2/20 | 0.50 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.50 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | NCF1 | P14598 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8291557 | 0.95 | ADRB1 (0.61) | ADRB1HTR1ASLC6A2SLC6A4HTR2A | |
| Hydrochloric Acid SCHEMBL7836810 | 0.93 | HTR1A (0.59) | ADRB1HTR1ASLC6A2SLC6A4HTR2C | |
| SCHEMBL15834289 | 0.91 | HTR2C (0.51) | ADRB1HTR1ASLC6A2SLC6A4HTR2C | |
| SCHEMBL4849498 | 0.90 | ADRB1 (0.56) | ADRB1HTR1ASLC6A2SLC6A4HTR2C | |
| SCHEMBL18701462 | 0.90 | HTR2C (0.50) | ADRB1HTR1ASLC6A2SLC6A4HTR2C | |
| SCHEMBL4849474 | 0.90 | ADRB1 (0.56) | ADRB1HTR1ASLC6A2SLC6A4HTR2C | |
| SCHEMBL4856101 | 0.90 | ADRB1 (0.56) | ADRB1HTR1ASLC6A2SLC6A4HTR2C | |
| SCHEMBL27868018 | 0.87 | HTR2C (0.47) | ADRB1HTR1ASLC6A2SLC6A4HTR2C | |
| SCHEMBL4420245 | 0.87 | ADRB1 (0.53) | ADRB1HTR1ASLC6A2SLC6A4HTR2A | |
| SCHEMBL4258576 | 0.84 | ADRB1 (0.50) | ADRB1HTR1ASLC6A2SLC6A4HTR2C |
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 |
|---|---|---|---|---|---|---|---|
| CN-109563043-A | SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 | 葛兰素史密斯克莱知识产权发展有限公司 | 2019-04-02 | — | — | CN | disclosed |