Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 4/20 | 0.38 |
| ▸ | PYCR1 | P32322 | 4/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9518403 | 0.98 | GBA1 (0.40) | GBA1KDM4ELMNAHTTMEN1 | |
| SCHEMBL8878400 | 0.90 | PYCR1 (0.44) | KDM4EHTTPYCR1CYP19A1TAAR1 | |
| SCHEMBL9737481 | 0.90 | AOC3 (0.45) | HTTAOC3PYCR1TAAR1HTR2A | |
| Hydrochloric Acid SCHEMBL9518394 | 0.88 | AOC3 (0.44) | HTTAOC3PYCR1TAAR1HTR2A | |
| SCHEMBL934617 | 0.81 | ESR1 (0.49) | AOC3PYCR1CYP19A1TAAR1HTR2A | |
| SCHEMBL9735994 | 0.81 | CNR2 (0.48) | LMNAHTTMEN1KMT2AAOC3 | |
| SCHEMBL934572 | 0.81 | BCL2A1 (0.51) | MEN1KMT2ASMN1; SMN2AOC3TAAR1 | |
| SCHEMBL9879437 | 0.81 | SLC6A2 (0.47) | LMNAMEN1KMT2AAOC3CYP19A1 | |
| SCHEMBL28980138 | 0.81 | AOC3 (0.47) | MEN1KMT2AAOC3 | |
| Hydrochloric Acid SCHEMBL9457770 | 0.80 | BCL2A1 (0.50) | MEN1KMT2ASMN1; SMN2AOC3 |
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-5081145-A | Contractile prostaglandin antagonists | MERCK FROSST CANADA, INC. (CA) | 1992-01-14 | — | — | US | disclosed |