Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | HRH1 | P35367 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 2/20 | 0.34 |
| ▸ | CFD | P00746 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 6/20 | 0.33 |
| ▸ | DPP8 | Q6V1X1 | 3/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 3/20 | 0.33 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL740450 | 1.00 | ALDH1A1 (0.35) | ALDH1A1TSHRKMT2ACYP2D6HRH1 | |
| SCHEMBL763304 | 0.92 | ALDH1A1 (0.35) | ALDH1A1TSHRKMT2ACYP2D6HRH1 | |
| SCHEMBL739245 | 0.87 | HRH1 (0.46) | CYP2D6HRH1KCNH2POLB | |
| SCHEMBL739244 | 0.87 | HRH1 (0.46) | CYP2D6HRH1KCNH2POLB | |
| SCHEMBL741263 | 0.86 | KCNH2 (0.38) | KMT2ACYP2D6HRH1KCNH2DPP4 | |
| SCHEMBL740883 | 0.86 | KCNH2 (0.38) | KMT2ACYP2D6HRH1KCNH2DPP4 | |
| SCHEMBL763813 | 0.86 | CTSB (0.37) | HRH1 | |
| SCHEMBL742676 | 0.86 | CYP2D6 (0.34) | ALDH1A1TSHRKMT2ACYP2D6HRH1 | |
| SCHEMBL738213 | 0.85 | KCNH2 (0.34) | ALDH1A1TSHRKMT2ACYP2D6HRH1 | |
| SCHEMBL738214 | 0.85 | KCNH2 (0.34) | ALDH1A1TSHRKMT2ACYP2D6HRH1 |
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-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 |