Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 11/20 | 0.57 |
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.57 |
| ▸ | MPO | P05164 | 3/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | HTR1D | P28221 | 3/20 | 0.42 |
| ▸ | HTR2C | P28335 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | HTR1B | P28222 | 2/20 | 0.42 |
| ▸ | HTR7 | P34969 | 2/20 | 0.42 |
| ▸ | HTR6 | P50406 | 2/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7816372 | 0.98 | HTR2A (0.55) | HTR2ATRPM8MPOSLC6A4MAPT | |
| SCHEMBL7817141 | 0.83 | HTR2A (0.54) | HTR2ATRPM8MPOSLC6A4MAPT | |
| Hydrochloric Acid SCHEMBL7816110 | 0.82 | HTR2A (0.53) | HTR2ATRPM8MPOSLC6A4MAPT | |
| SCHEMBL8197784 | 0.76 | TRPM8 (0.48) | HTR2ATRPM8MPOSLC6A4MAPT | |
| SCHEMBL30037383 | 0.76 | MPO (0.68) | HTR2ATRPM8MPOSLC6A4MAPT | |
| SCHEMBL7818167 | 0.76 | MPO (0.68) | HTR2ATRPM8MPOSLC6A4MAPT | |
| Hydrochloric Acid SCHEMBL7817071 | 0.75 | MAPT (0.67) | HTR2ATRPM8MPOSLC6A4MAPT | |
| SCHEMBL31744871 | 0.73 | GPR84 (0.47) | HTR2ATRPM8MAPTNPSR1HTR6 | |
| SCHEMBL1520598 | 0.72 | HTR2A (1.00) | HTR2ATRPM8MPOSLC6A4MAPT | |
| SCHEMBL29791683 | 0.72 | HTR2A (1.00) | HTR2ATRPM8MPOSLC6A4MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0620222-A2 | Tetrahydro-beta-carbolines | ELI LILLY AND COMPANY (US) | 1994-10-19 | — | — | EP | disclosed |