Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.31 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.30 |
| ▸ | AR | P10275 | 1/20 | 0.30 |
| ▸ | CDK4 | P11802 | 1/20 | 0.30 |
| ▸ | CCND1 | P24385 | 1/20 | 0.30 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24391784 | 0.83 | KDM4E (0.32) | HTTALDH1A1CDK4CCND1 | |
| SCHEMBL24393152 | 0.79 | KDM4E (0.38) | HTTMAPTTP53CYP1A2ALDH1A1 | |
| SCHEMBL24393118 | 0.78 | MAPT (0.37) | MAPTALDH1A1LMNADPP4KMT2A | |
| SCHEMBL24393365 | 0.74 | MBOAT4 (0.35) | HTTALDH1A1PDE2A | |
| SCHEMBL20280010 | 0.69 | GRIN1 (0.38) | TP53KMT2AHSD17B10PDE10ACDK4 | |
| SCHEMBL19560852 | 0.68 | PDE10A (0.52) | HTTHAVCR2HSD11B1PDE10ACDK4 | |
| SCHEMBL20088561 | 0.68 | PDE10A (0.38) | HTTTP53LMNAKMT2AHSD17B10 | |
| SCHEMBL24392191 | 0.67 | HAVCR2 (0.32) | MAPTALDH1A1LMNAHAVCR2 | |
| SCHEMBL20094275 | 0.66 | PDE10A (0.36) | HTTTP53ALDH1A1KMT2AHSD17B10 | |
| SCHEMBL24392656 | 0.65 | GRM8 (0.35) | MAPTTP53CYP1A2ALDH1A1LMNA |
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-2022091048-A1 | ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF | INTEGRAL BIOSCIENCES PRIVATE LIMITED (IN) | 2022-05-05 | — | — | WO | disclosed |