Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Dimpylate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.92 |
| ▸ | TSHR | P16473 | 4/20 | 0.92 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.92 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.92 |
| ▸ | TP53 | P04637 | 1/20 | 0.92 |
| ▸ | ACHE | P22303 | 1/20 | 0.92 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PRNP | P04156 | 1/20 | 0.30 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| Dimpylate SCHEMBL17453 | 0.96 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL6118696 | 0.96 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL28706929 | 0.95 | ALDH1A1 (0.92) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL9812732 | 0.95 | ALDH1A1 (0.92) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL28091934 | 0.94 | ALDH1A1 (0.97) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL6214077 | 0.94 | ALDH1A1 (0.97) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL3841005 | 0.94 | ALDH1A1 (0.97) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL1344740 | 0.94 | ALDH1A1 (0.97) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL27949432 | 0.94 | ALDH1A1 (0.97) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL6753267 | 0.94 | ALDH1A1 (0.97) | ALDH1A1TSHRCYP3A4HSD17B10TP53 |
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-2008123763-A1 | ASSAY FOR CHOLINESTERASE-INHIBITING COMPOUNDS | KHIAZH SDN BHD (MY) | 2008-10-16 | — | — | WO | disclosed |