Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.69 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.65 |
| ▸ | RAB9A | P51151 | 2/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.65 |
| ▸ | NPC1 | O15118 | 1/20 | 0.65 |
| ▸ | TSHR | P16473 | 2/20 | 0.62 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | CASP3 | P42574 | 1/20 | 0.61 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | MITF | O75030 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL5101418 | 0.84 | KMT2A (0.82) | CYP1A2CYP2C9CYP2C19KMT2ASMN1; SMN2 | |
| SCHEMBL7226854 | 0.84 | ALDH1A1 (0.75) | CYP1A2CYP2C9CYP2C19KMT2ASMN1; SMN2 | |
| SCHEMBL8247308 | 0.81 | CYP1A2 (1.00) | CYP1A2CYP2C9CYP2C19KMT2ASMN1; SMN2 | |
| SCHEMBL30520172 | 0.81 | CYP1A2 (0.71) | CYP1A2CYP2C9CYP2C19KMT2ASMN1; SMN2 | |
| SCHEMBL7385489 | 0.81 | KMT2A (0.58) | CYP1A2CYP2C9CYP2C19KMT2ASMN1; SMN2 | |
| SCHEMBL5649640 | 0.79 | KMT2A (1.00) | CYP1A2CYP2C9CYP2C19KMT2ASMN1; SMN2 | |
| SCHEMBL5649217 | 0.79 | HSD17B10 (0.81) | CYP1A2CYP2C9CYP2C19KMT2ASMN1; SMN2 | |
| SCHEMBL1665144 | 0.79 | CYP1A2 (0.68) | CYP1A2CYP2C9CYP2C19KMT2ASMN1; SMN2 | |
| SCHEMBL2419713 | 0.79 | CYP1A2 (0.68) | CYP1A2CYP2C9CYP2C19KMT2ASMN1; SMN2 | |
| SCHEMBL5650663 | 0.78 | CYP1A2 (0.66) | CYP1A2CYP2C9CYP2C19KMT2ASMN1; SMN2 |
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-5272268-A | Dipeptide derivatives | SHIONOGI & CO., LTD. (JP) | 1993-12-21 | — | — | US | disclosed |
| US-5223615-A | Hypotensive agents | SHIONOGI & CO., LTD. (JP) | 1993-06-29 | — | — | US | disclosed |
| US-5194608-A | Hypotensive agents; inhibits renin-angiotensin system | SHIONOGI & CO., LTD. (JP) | 1993-03-16 | — | — | US | disclosed |
| EP-0468641-A2 | Renin inhibiting dipeptide derivatives, their preparation and pharmaceutical preparations containing them | SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) | 1992-01-29 | — | — | EP | disclosed |