Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 12/20 | 0.65 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.65 |
| ▸ | SLC22A11 | Q9NSA0 | 1/20 | 0.65 |
| ▸ | SLC2A9 | Q9NRM0 | 3/20 | 0.60 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | CCR5 | P51681 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL253614 | 0.93 | SLC22A12 (0.62) | SLC22A12CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL10029207 | 0.92 | SLC22A12 (0.53) | SLC22A12CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL248221 | 0.91 | SLC22A12 (0.65) | SLC22A12CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL29376753 | 0.91 | SLC22A12 (0.65) | SLC22A12CYP2C9CYP2C19CYP3A4CYP2D6 | |
| Potassium SCHEMBL30892115 | 0.90 | SLC22A12 (0.64) | SLC22A12CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL14921536 | 0.90 | SLC22A12 (0.64) | SLC22A12CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL10029331 | 0.88 | SLC22A12 (0.49) | SLC22A12CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL249261 | 0.87 | SLC22A12 (0.66) | SLC22A12CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL12056187 | 0.85 | SLC22A12 (0.64) | SLC22A12CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL10029197 | 0.84 | SLC22A12 (0.51) | SLC22A12CYP2C9CYP2C19CYP3A4CYP2D6 |
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-1789039-B1 | S-TRIAZOLYL ALPHA -MERCAPTOACETANILDES AS INHIBITORS OF HIV REVERSE TRANSCRIPTASE | ARDEA BIOSCIENCES INC (US) | 2012-01-11 | — | — | EP | claimed |