Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.71 |
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | MPO | P05164 | 4/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1094058 | 0.86 | ESR2 (0.75) | ESR2NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL28792817 | 0.85 | ESR2 (0.74) | ESR2NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL3603218 | 0.83 | ESR2 (1.00) | ESR2NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28194706 | 0.83 | ESR2 (0.71) | ESR2NPC1RAB9AMEN1KMT2A | |
| SCHEMBL9910895 | 0.80 | ESR2 (0.50) | ESR2NPC1RAB9AMEN1KMT2A | |
| SCHEMBL3593552 | 0.79 | ESR2 (0.65) | ESR2NPC1RAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL3591758 | 0.74 | ESR2 (0.58) | ESR2NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL3591275 | 0.74 | ESR2 (0.58) | ESR2NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL29028680 | 0.72 | NPC1 (0.43) | ESR2NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28748708 | 0.71 | RAB9A (0.46) | ESR2NPC1RAB9AMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007039146-A1 | 4-CARBOXY PYRAZOLE DERIVATIVES AS ANTI-VIRAL AGENTS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-04-12 | — | — | WO | disclosed |