Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | BTK | Q06187 | 2/20 | 0.52 |
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.39 |
| ▸ | CKS1B | P61024 | 1/20 | 0.39 |
| ▸ | SKP1 | P63208 | 1/20 | 0.39 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL20106543 | 0.86 | KMT2A (0.53) | KMT2AL3MBTL1BTKKDM1AMAOB | |
| SCHEMBL21232389 | 0.86 | KMT2A (0.53) | KMT2AL3MBTL1BTKKDM1AMAOB | |
| SCHEMBL21232390 | 0.85 | KMT2A (0.52) | KMT2AL3MBTL1BTKKDM1AMAOB | |
| SCHEMBL20106566 | 0.85 | KMT2A (0.52) | KMT2AL3MBTL1BTKKDM1AMAOB | |
| SCHEMBL21311673 | 0.84 | KMT2A (0.51) | KMT2AL3MBTL1BTKKDM1AMAOB | |
| SCHEMBL21232399 | 0.83 | BTK (0.60) | KMT2AL3MBTL1BTKKDM1AMAOB | |
| SCHEMBL21232478 | 0.83 | BTK (0.60) | KMT2AL3MBTL1BTKKDM1AMAOB | |
| SCHEMBL21221581 | 0.81 | ALDH1A1 (0.41) | KMT2AL3MBTL1HTTNPC1RAB9A | |
| SCHEMBL12635237 | 0.79 | KDM1A (0.52) | KMT2AL3MBTL1BTKKDM1AMAOB | |
| SCHEMBL21232481 | 0.79 | KMT2A (0.56) | KMT2AL3MBTL1BTKKDM1AMAOB |
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-2018080897-A1 | PD-CATALYZED γ-C(SP3)-H ARYLATION / HETEROARYLATION OF FREE AMINES | THE SCRIPPS RESEARCH INSTITUTE (US) | 2018-05-03 | — | — | WO | disclosed |