Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.44 |
| ▸ | TBXAS1 | P24557 | 7/20 | 0.43 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.43 |
| ▸ | PNP | P00491 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | F7 | P08709 | 1/20 | 0.41 |
| ▸ | F3 | P13726 | 1/20 | 0.41 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.41 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.41 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.41 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.41 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.41 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.41 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL28613561 | 0.84 | PLA2G10 (0.46) | MEN1KMT2A | |
| SCHEMBL13728047 | 0.76 | GRM2 (0.47) | RECQLGRM2TBXAS1NAPRTCYP3A4 | |
| SCHEMBL29817984 | 0.74 | RECQL (0.50) | RECQLTBXAS1NAPRTCYP3A4CYP1A2 | |
| SCHEMBL16598255 | 0.74 | RECQL (0.50) | RECQLTBXAS1NAPRTCYP3A4CYP1A2 | |
| SCHEMBL28826508 | 0.74 | IKBKB (0.54) | CYP3A4CYP1A2F7F3SARM1 | |
| SCHEMBL1161996 | 0.74 | RECQL (0.50) | RECQLTBXAS1NAPRTCYP3A4CYP1A2 | |
| Hydrochloric Acid SCHEMBL17906582 | 0.72 | RECQL (0.49) | RECQLTBXAS1NAPRTCYP3A4CYP1A2 | |
| SCHEMBL28190937 | 0.72 | TBXAS1 (0.46) | RECQLTBXAS1NAPRTCYP3A4CYP1A2 | |
| Hydrochloric Acid SCHEMBL17204692 | 0.71 | RECQL (0.44) | RECQLGRM2TBXAS1NAPRTCYP3A4 | |
| SCHEMBL13728559 | 0.71 | RECQL (0.44) | RECQLGRM2TBXAS1NAPRTCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101014571-A | N-benzyl-3,4-dihyroxypyridine-2-carboxamide and n-benzyl-2,3-dihydroxypyridine-4- carboxamide compounds useful as HIV integrase inhibitors | MERCK & CO INC (US) | 2007-08-08 | — | — | CN | disclosed |