Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NLRP3 | Q96P20 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL45391 | 0.73 | HTR7 (0.36) | ALDH1A1LMNAMEN1KMT2AKDM4E | |
| SCHEMBL28401182 | 0.72 | ALDH1A1 (0.72) | ALDH1A1HPGDPTPN1SMN1; SMN2MAPT | |
| SCHEMBL6557517 | 0.72 | HPGD (0.63) | ALDH1A1HPGDPTPN1SMN1; SMN2MAPT | |
| SCHEMBL6888962 | 0.72 | TSHR (0.45) | ALDH1A1SMN1; SMN2MAPTLMNAHSD17B10 | |
| SCHEMBL69360 | 0.71 | NPC1 (0.71) | ALDH1A1HPGDSMN1; SMN2MAPTLMNA | |
| SCHEMBL30593915 | 0.71 | NPC1 (0.71) | ALDH1A1HPGDSMN1; SMN2MAPTLMNA | |
| SCHEMBL1934600 | 0.70 | ALDH1A1 (0.40) | ALDH1A1HPGDSMN1; SMN2MAPTLMNA | |
| SCHEMBL2587914 | 0.70 | PPIA (0.40) | ALDH1A1HPGDMAPTKMT2ACYP1A2 | |
| SCHEMBL114462 | 0.70 | CA1 (0.35) | SMN1; SMN2MAPTLMNAHSD17B10KMT2A | |
| SCHEMBL9342000 | 0.70 | ALDH1A1 (0.78) | ALDH1A1HPGDPTPN1SMN1; SMN2MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2303897-A1 | HIGH-VALENT PALLADIUM FLUORIDE COMPLEXES AND USES THEREOF | President and Fellows of Harvard College (US) | 2011-04-06 | — | — | EP | disclosed |
| WO-2009149347-A1 | HIGH-VALENT PALLADIUM FLUORIDE COMPLEXES AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2009-12-10 | — | — | WO | disclosed |