Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | AMPD2 | Q01433 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | GRM6 | O15303 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1642227 | 0.78 | ALDH1A1 (0.39) | ALDH1A1MEN1KMT2AHPGDGAA | |
| SCHEMBL1190560 | 0.72 | LMNA (0.41) | ALDH1A1CYP3A4MEN1KMT2AHSD17B10 | |
| SCHEMBL1190461 | 0.72 | LMNA (0.41) | ALDH1A1CYP3A4MEN1KMT2AHSD17B10 | |
| SCHEMBL1189315 | 0.72 | LMNA (0.41) | ALDH1A1CYP3A4MEN1KMT2AHSD17B10 | |
| SCHEMBL1189580 | 0.72 | LMNA (0.41) | ALDH1A1CYP3A4MEN1KMT2AHSD17B10 | |
| SCHEMBL2389761 | 0.72 | CYP3A4 (0.41) | ALDH1A1CYP3A4MEN1KMT2AMAPT | |
| SCHEMBL3870397 | 0.71 | GRIN2B (0.36) | ALDH1A1AMPD2MEN1KMT2AHPGD | |
| SCHEMBL2816311 | 0.71 | GRIN2B (0.36) | ALDH1A1AMPD2MEN1KMT2AHPGD | |
| SCHEMBL28898469 | 0.70 | MAPT (0.36) | ALDH1A1MEN1KMT2AMAPTHPGD | |
| SCHEMBL14881906 | 0.70 | ALDH1A1 (0.38) | ALDH1A1MEN1KMT2AHSD11B1 |
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-8013008-B2 | Cyclic amine compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-09-06 | — | — | US | disclosed |