Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21595906 | 0.91 | KMT2A (0.43) | MRGPRX4KMT2ARAB9AHPGDMEN1 | |
| SCHEMBL21596024 | 0.89 | HPGD (0.50) | KMT2ARAB9AHPGDMEN1LMNA | |
| SCHEMBL21113945 | 0.86 | MEN1 (0.47) | KMT2ARAB9AMEN1LMNATP53 | |
| SCHEMBL21595963 | 0.81 | MEN1 (0.61) | KMT2ARAB9AMEN1LMNATP53 | |
| SCHEMBL14102238 | 0.80 | L3MBTL1 (0.54) | KMT2ARAB9AHPGDMEN1LMNA | |
| SCHEMBL21114078 | 0.79 | SMN1; SMN2 (0.41) | KMT2AMEN1MAPK1SMN1; SMN2CHRM2 | |
| SCHEMBL13411719 | 0.79 | CHRNB2 (0.57) | KMT2ARAB9AMEN1LMNATP53 | |
| SCHEMBL21595781 | 0.78 | CHRNB2 (0.49) | KMT2ARAB9AMEN1LMNATP53 | |
| SCHEMBL10878950 | 0.78 | MEN1 (0.57) | KMT2ARAB9AMEN1LMNATP53 | |
| SCHEMBL21595691 | 0.76 | LMNA (0.66) | KMT2ARAB9AHPGDMEN1LMNA |
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-2019244066-A2 | PYRIDIN-3-YL ACETIC ACID DERIVATIVES AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | VIIV Healthcare UK (No.5) Limited (GB) | 2019-12-26 | — | — | WO | disclosed |