Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.48 |
| ▸ | HTR2C | P28335 | 2/20 | 0.48 |
| ▸ | HTR2B | P41595 | 2/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| Carbamic Acid SCHEMBL7350110 | 0.92 | HTR2C (0.49) | CYP17A1CYP1A2HTR2CHTR2BADRA2A | |
| SCHEMBL7642376 | 0.81 | CYP17A1 (0.55) | CYP17A1CYP1A2HTR2CHTR2BADRA2A | |
| SCHEMBL19383233 | 0.81 | CYP17A1 (0.57) | CYP17A1CYP1A2HTR2CHTR2BADRA2A | |
| SCHEMBL8160351 | 0.81 | CYP17A1 (0.57) | CYP17A1CYP1A2HTR2CHTR2BADRA2A | |
| SCHEMBL7166658 | 0.78 | CYP17A1 (0.55) | CYP17A1CYP1A2HTR2CHTR2BADRA2A | |
| SCHEMBL9261363 | 0.78 | CYP17A1 (0.54) | CYP17A1CYP1A2HTR2CHTR2BADRA2A | |
| SCHEMBL8610358 | 0.77 | CYP17A1 (0.51) | CYP17A1CYP1A2HTR2CHTR2BADRA2A | |
| SCHEMBL28794469 | 0.77 | SRD5A2 (0.53) | CYP17A1CYP1A2HTR2CHTR2BADRA2A | |
| SCHEMBL9225138 | 0.77 | GAA (0.55) | CYP17A1CYP1A2HTR2CHTR2BADRA2A | |
| Cicloprofen SCHEMBL42839 | 0.76 | PTGS2 (0.56) | CYP17A1CYP1A2HTR2CHTR2BADRA2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4981865-A | N-hydroxyamide, N-hydroxythioamide, hydroxyurea, and N-hydroxythiourea derivatives of selected nsaids as antiinflammatory agents | WARNER-LAMBERT CO. (US) | 1991-01-01 | — | — | US | claimed |
| US-5112846-A | Nonsteroidal antiinflammatory agents | WARNER-LAMBERT COMPANY (US) | 1992-05-12 | — | — | US | disclosed |
| US-5075330-A | N-hydroxyamide, N-hydroxythioamide, N-hydroxyurea, and N-hydroxythiourea derivatives of selected NSAIDS as antiinflammatory agents | WARNER-LAMBERT CO. (US) | 1991-12-24 | — | — | US | disclosed |
| US-4981865-A | N-hydroxyamide, N-hydroxythioamide, hydroxyurea, and N-hydroxythiourea derivatives of selected nsaids as antiinflammatory agents | WARNER-LAMBERT CO. (US) | 1991-01-01 | — | — | US | disclosed |