Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCA | P06881 | 7/20 | 0.61 |
| ▸ | COMT | P21964 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | TP53 | P04637 | 3/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | METAP2 | P50579 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4769028 | 0.83 | CALCA (0.74) | CALCACOMTKDM4ETP53ALOX15 | |
| SCHEMBL4067964 | 0.82 | CALCA (0.69) | CALCACOMTKDM4ETP53ALOX15 | |
| SCHEMBL4072599 | 0.81 | CALCA (0.68) | CALCACOMTKDM4ETP53ALOX15 | |
| SCHEMBL966418 | 0.80 | CALCA (0.59) | CALCACOMTKDM4ETP53ALOX15 | |
| SCHEMBL14435145 | 0.80 | CALCA (0.59) | CALCACOMTKDM4ETP53ALOX15 | |
| SCHEMBL968119 | 0.80 | CALCA (0.78) | CALCACOMTTP53ALOX15NPC1 | |
| SCHEMBL7258795 | 0.80 | CALCA (0.69) | CALCACOMTKDM4EL3MBTL1RAB9A | |
| SCHEMBL4067727 | 0.79 | CALCA (0.65) | CALCACOMTKDM4ETP53ALOX15 | |
| SCHEMBL1198641 | 0.74 | CALCA (1.00) | CALCASMN1; SMN2 | |
| SCHEMBL29393055 | 0.74 | CALCA (1.00) | CALCASMN1; SMN2 |
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-1664046-B1 | AZA-QUINOLINOL PHOSPHONATE INTEGRASE INHIBITOR COMPOUNDS | GILEAD SCIENCES INC (US) | 2009-06-17 | — | — | EP | disclosed |