Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 5/20 | 0.36 |
| ▸ | CALM1 | P0DP23 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.33 |
| ▸ | HMGCR | P04035 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4602449 | 0.78 | TACR1 (0.52) | TACR1CALM1ALDH1A1 | |
| SCHEMBL14838199 | 0.78 | TACR1 (0.38) | TACR1GABRA1GABRB2L3MBTL1HMGCR | |
| SCHEMBL88992 | 0.78 | PTGS2 (0.37) | TACR1CALM1PTGS2GABRA1GABRG2 | |
| SCHEMBL4602443 | 0.77 | TACR1 (0.35) | TACR1CALM1PTGS2GABRA1GABRG2 | |
| SCHEMBL90337 | 0.77 | DAO (0.41) | TACR1CALM1MAPTPTGS2GABRA1 | |
| SCHEMBL8265190 | 0.77 | TACR1 (0.35) | TACR1CALM1PTGS2GABRA1GABRG2 | |
| SCHEMBL8264225 | 0.77 | TACR1 (0.35) | TACR1CALM1PTGS2GABRA1GABRG2 | |
| SCHEMBL1204935 | 0.76 | NR1H4 (0.38) | TACR1MAPTL3MBTL1MEN1NPC1 | |
| SCHEMBL22861019 | 0.75 | PTGS2 (0.41) | CALM1PTGS2GABRA1GABRG2GABRB3 | |
| SCHEMBL1205032 | 0.75 | CA1 (0.43) | MAPTCA1CA2L3MBTL1MEN1 |
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 |