Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.59 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CTSL | P07711 | 1/20 | 0.46 |
| ▸ | CTSS | P25774 | 1/20 | 0.46 |
| ▸ | CTSK | P43235 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CMA1 | P23946 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.45 |
| ▸ | DPP4 | P27487 | 1/20 | 0.44 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.44 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8481116 | 0.88 | CYP2A6 (0.58) | CYP2A6TAAR1POLBSMN1; SMN2TP53 | |
| SCHEMBL8486771 | 0.87 | CYP2A6 (0.49) | CYP2A6TAAR1POLBSMN1; SMN2TP53 | |
| SCHEMBL8432969 | 0.85 | CYP2A6 (0.54) | CYP2A6TAAR1POLBSMN1; SMN2TP53 | |
| SCHEMBL514508 | 0.85 | CYP2A6 (0.54) | CYP2A6TAAR1POLBSMN1; SMN2TP53 | |
| SCHEMBL29373380 | 0.85 | CYP2A6 (0.54) | CYP2A6TAAR1POLBSMN1; SMN2TP53 | |
| SCHEMBL514509 | 0.85 | CYP2A6 (0.54) | CYP2A6TAAR1POLBSMN1; SMN2TP53 | |
| SCHEMBL1421072 | 0.85 | CYP2A6 (0.54) | CYP2A6TAAR1POLBSMN1; SMN2TP53 | |
| SCHEMBL14947066 | 0.85 | CYP2A6 (0.54) | CYP2A6TAAR1POLBSMN1; SMN2TP53 | |
| SCHEMBL21309831 | 0.85 | CYP2A6 (0.54) | CYP2A6TAAR1POLBSMN1; SMN2TP53 | |
| SCHEMBL2466886 | 0.85 | CYP2A6 (0.54) | CYP2A6TAAR1POLBSMN1; SMN2TP53 |
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-5459131-A | Renin inhibitors | AMERICAN CYANAMID COMPANY (US) | 1995-10-17 | — | — | US | disclosed |