Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2 | P10415 | 2/20 | 0.47 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.45 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | ACSS2 | Q9NR19 | 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 | |
|---|---|---|---|---|
| SCHEMBL14288446 | 0.79 | SIGMAR1 (0.49) | BCL2SCN5ASCN9AHTR2AHTR2C | |
| SCHEMBL9540116 | 0.76 | CDC7 (0.40) | BCL2SCN5ASCN9APOLBSMN1; SMN2 | |
| SCHEMBL5159643 | 0.75 | SIGMAR1 (0.62) | BCL2HTR2AKCNH2SIGMAR1SMN1; SMN2 | |
| SCHEMBL11622213 | 0.74 | PGR (0.42) | BCL2SCN5ASCN9AHTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL10512222 | 0.74 | CHRM4 (0.62) | BCL2HTR2AKCNH2SIGMAR1SMN1; SMN2 | |
| SCHEMBL11620037 | 0.74 | HTR2A (0.47) | BCL2SCN5ASCN9AHTR2AHTR2C | |
| SCHEMBL12267924 | 0.73 | SCN5A (0.65) | BCL2SCN5ASCN9ASIGMAR1KIF11 | |
| SCHEMBL17073435 | 0.73 | SIGMAR1 (0.49) | BCL2SCN5ASCN9AHTR2AKCNH2 | |
| SCHEMBL31067545 | 0.73 | SIGMAR1 (0.49) | BCL2SCN5ASCN9AHTR2AKCNH2 | |
| SCHEMBL9540122 | 0.71 | HTR2A (0.43) | BCL2SCN5ASCN9AHTR2AHTR2C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0530994-A1 | Quinazoline derivatives as inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1993-03-10 | — | — | EP | disclosed |
| WO-1993004047-A1 | QUINAZOLINE DERIVATIVES AS INHIBITORS OF HIV REVERSE TRANSCRIPTASE | MERCK & CO., INC. (US) | 1993-03-04 | — | — | WO | disclosed |