Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A3 | P43003 | 2/20 | 0.47 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.47 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27623951 | 0.81 | SLC1A3 (0.44) | SLC1A3SLC1A2SLC1A1KMT2ACYP1A2 | |
| SCHEMBL9756273 | 0.80 | CES1 (0.45) | KMT2ACYP1A2CYP2D6CYP2C19TDP1 | |
| SCHEMBL11401618 | 0.77 | SLC1A3 (0.49) | SLC1A3SLC1A2SLC1A1KMT2ACYP1A2 | |
| SCHEMBL3349927 | 0.76 | CYP1A2 (0.52) | CYP1A2CYP2D6CYP2C19TDP1SMN1; SMN2 | |
| SCHEMBL2689315 | 0.75 | SLC1A3 (0.46) | SLC1A3SLC1A2SLC1A1KMT2ACYP1A2 | |
| SCHEMBL10853441 | 0.74 | SLC1A3 (0.45) | SLC1A3SLC1A2SLC1A1KMT2ACYP1A2 | |
| SCHEMBL16634782 | 0.73 | FABP5 (0.45) | SLC1A3SLC1A2SLC1A1KMT2ACYP1A2 | |
| SCHEMBL4647195 | 0.72 | ALDH1A1 (0.44) | SLC1A3SLC1A2SLC1A1KMT2ACYP1A2 | |
| SCHEMBL3345739 | 0.72 | CES1 (0.46) | KMT2ACYP1A2CYP2D6CYP2C19NPC1 | |
| SCHEMBL6064499 | 0.72 | ALDH1A1 (0.50) | SLC1A3SLC1A2SLC1A1KMT2ACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0036713-A2 | Angiotensin converting enzyme inhibitors | UNIVERSITY OF MIAMI (US) | 1981-09-30 | — | — | EP | disclosed |