Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANPEP | P15144 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | AKT1 | P31749 | 3/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.34 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.34 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.34 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.34 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.34 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL11553791 | 1.00 | ANPEP (0.36) | ANPEPSMN1; SMN2AKT1CHRM2CHRM4 | |
| SCHEMBL9971048 | 0.74 | KMT2A (0.37) | ANPEPSMN1; SMN2KMT2ACYP2C9CYP2C19 | |
| SCHEMBL30804405 | 0.74 | KMT2A (0.37) | ANPEPSMN1; SMN2KMT2ACYP2C9CYP2C19 | |
| SCHEMBL9940902 | 0.74 | KMT2A (0.37) | ANPEPSMN1; SMN2KMT2ACYP2C9CYP2C19 | |
| SCHEMBL9940942 | 0.74 | KMT2A (0.37) | ANPEPSMN1; SMN2KMT2ACYP2C9CYP2C19 | |
| SCHEMBL17589652 | 0.74 | ANPEP (0.41) | ANPEPSMN1; SMN2KMT2ACYP1A2IDO1 | |
| SCHEMBL23190683 | 0.73 | KMT2A (0.42) | ANPEPKMT2ACYP2C9CYP2C19 | |
| SCHEMBL1809864 | 0.73 | IDO1 (0.44) | ANPEPKMT2AIDO1 | |
| SCHEMBL11138446 | 0.73 | IDO1 (0.44) | ANPEPKMT2AIDO1 | |
| SCHEMBL27213573 | 0.73 | IDO1 (0.44) | ANPEPKMT2AIDO1 |
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-4173640-A | Hypotensive perhydro naphthalene pentol derivatives | E. R. SQUIBB & SONS, INC. (US) | 1979-11-06 | — | — | US | disclosed |
| US-4156723-A | HYPOTENSIVE | E. R. SQUIBB & SONS, INC. (US) | 1979-05-29 | — | — | US | disclosed |