Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 5/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.47 |
| ▸ | REN | P00797 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 3/20 | 0.42 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.40 |
| ▸ | GHSR | Q92847 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL78618 | 0.76 | SLC6A4 (0.51) | SLC6A4SLC6A2RENCYP3A4SLC6A3 | |
| SCHEMBL65338 | 0.75 | SLC6A4 (0.58) | SLC6A4SLC6A2RENCYP3A4SLC6A3 | |
| SCHEMBL79378 | 0.75 | SLC6A4 (0.64) | SLC6A4SLC6A2RENCYP3A4SLC6A3 | |
| SCHEMBL5483040 | 0.72 | MEN1 (0.52) | SLC6A4SLC6A2CYP3A4GHSRMEN1 | |
| SCHEMBL10058367 | 0.72 | CTRB1 (0.54) | CYP3A4CTRB1MEN1LMNAKMT2A | |
| SCHEMBL264008 | 0.70 | CTRB1 (0.61) | CASP1CTRB1 | |
| SCHEMBL553905 | 0.70 | CTRB1 (0.61) | CASP1CTRB1 | |
| SCHEMBL553906 | 0.70 | CTRB1 (0.61) | CASP1CTRB1 | |
| SCHEMBL4829896 | 0.70 | CTRB1 (0.68) | CTRB1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL24324242 | 0.69 | CTRB1 (0.53) | CYP3A4CYP2D6CASP1CTRB1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8129538-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-06 | — | — | US | disclosed |
| US-8129538-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-06 | — | — | US | disclosed |