Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 19/20 | 0.57 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | THPO | P40225 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL13629801 | 0.94 | TACR1 (0.65) | TACR1TP53CYP1A2CYP3A4CYP2D6 | |
| Oxalic Acid SCHEMBL4474229 | 0.89 | TACR1 (0.59) | TACR1 | |
| Oxalic Acid SCHEMBL4474226 | 0.89 | TACR1 (0.59) | TACR1 | |
| Oxalic Acid SCHEMBL4474233 | 0.89 | TACR1 (0.59) | TACR1 | |
| SCHEMBL13637835 | 0.83 | TACR1 (0.53) | TACR1 | |
| SCHEMBL4469280 | 0.81 | TACR1 (0.65) | TACR1 | |
| SCHEMBL4480159 | 0.81 | TACR1 (0.61) | TACR1TP53CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4480154 | 0.81 | TACR1 (0.61) | TACR1TP53CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4469274 | 0.81 | TACR1 (0.65) | TACR1 | |
| SCHEMBL4480151 | 0.81 | TACR1 (0.61) | TACR1TP53CYP1A2CYP3A4CYP2D6 |
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-7622487-B2 | Piperidine derivative, process for producing the same, and use | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-11-24 | — | — | US | disclosed |