Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 4/20 | 0.36 |
| ▸ | PPIA | P62937 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | DRD4 | P21917 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | HTR5A | P47898 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9820926 | 0.76 | PPIA (0.45) | HTR1APPIAHTTMEN1CYP1A2 | |
| Hydrochloric Acid SCHEMBL9820718 | 0.75 | PPIA (0.44) | HTR1APPIAHTTMEN1CYP1A2 | |
| SCHEMBL11621531 | 0.73 | PPIA (0.40) | ESR2PPIAHRH1MEN1KMT2A | |
| SCHEMBL11619641 | 0.73 | PPIA (0.38) | ESR2PPIAMEN1KMT2AESR1 | |
| SCHEMBL11617226 | 0.72 | SIGMAR1 (0.38) | ESR2POLBHTR1AHTTHTR2A | |
| SCHEMBL11854291 | 0.70 | HTR2A (0.44) | PPIAHTR2AHRH1DRD2 | |
| SCHEMBL10468985 | 0.68 | HTR1A (0.47) | HTR1AHTTCYP1A2CYP2D6DRD2 | |
| Hydrochloric Acid SCHEMBL9820644 | 0.68 | PPIA (0.41) | PPIAMEN1KMT2A | |
| SCHEMBL12813351 | 0.67 | PPIA (0.47) | ESR2POLBPPIAMEN1KMT2A | |
| SCHEMBL7545655 | 0.66 | NOS1 (0.36) | ESR2PPIAHTR2AHRH1MEN1 |
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-4130649-A | Cyclohepta [B]pyridine-2-carboxylic acid derivatives | AYERST, MCKENNA & HARRISON LIMITED (CA) | 1978-12-19 | — | — | US | disclosed |