Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.35 |
| ▸ | CTSC | P53634 | 3/20 | 0.35 |
| ▸ | PADI4 | Q9UM07 | 2/20 | 0.34 |
| ▸ | BTK | Q06187 | 2/20 | 0.33 |
| ▸ | CFD | P00746 | 2/20 | 0.32 |
| ▸ | BMPR1A | P36894 | 2/20 | 0.32 |
| ▸ | ACVRL1 | P37023 | 2/20 | 0.32 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.32 |
| ▸ | NPY1R | P25929 | 3/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.32 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL741987 | 1.00 | SMYD3 (0.35) | SMYD3CTSCPADI4BTKCFD | |
| SCHEMBL742052 | 0.89 | AKT1 (0.36) | SMYD3PADI4BTKCFDNPY1R | |
| SCHEMBL741966 | 0.89 | AKT1 (0.36) | SMYD3PADI4BTKCFDNPY1R | |
| SCHEMBL738530 | 0.86 | KMT2A (0.36) | CTSCBTKCFDNPY1RALDH1A1 | |
| SCHEMBL738529 | 0.86 | KMT2A (0.36) | CTSCBTKCFDNPY1RALDH1A1 | |
| SCHEMBL740270 | 0.86 | KMT2A (0.36) | CTSCBTKCFDNPY1RALDH1A1 | |
| SCHEMBL740398 | 0.85 | ALDH1A1 (0.36) | CTSCBTKCFDNPY1RALDH1A1 | |
| SCHEMBL740397 | 0.85 | ALDH1A1 (0.36) | CTSCBTKCFDNPY1RALDH1A1 | |
| SCHEMBL741161 | 0.85 | BTK (0.31) | CTSCBTKCFDNPY1RBRD4 | |
| SCHEMBL741160 | 0.85 | BTK (0.31) | CTSCBTKCFDNPY1RBRD4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | claimed |
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |