Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.42 |
| ▸ | PARP1 | P09874 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6258469 | 0.90 | ALDH1A1 (0.46) | ALDH1A1HSD17B10PARP1LMNAMAPT | |
| SCHEMBL2964481 | 0.89 | PARP1 (0.45) | ALDH1A1HSD17B10PARP1LMNAMAPT | |
| SCHEMBL10903924 | 0.88 | CYP3A4 (0.48) | ALDH1A1HSD17B10PARP1LMNAMAPT | |
| SCHEMBL5135888 | 0.86 | MMP2 (0.52) | ALDH1A1HSD17B10MAPTKDM4EHPGD | |
| SCHEMBL3622851 | 0.85 | PARP1 (0.46) | ALDH1A1HSD17B10PARP1LMNAMAPT | |
| Hydrochloric Acid SCHEMBL28057982 | 0.84 | PARP1 (0.45) | ALDH1A1HSD17B10PARP1LMNAMAPT | |
| SCHEMBL3352032 | 0.82 | PARP1 (0.41) | ALDH1A1HSD17B10PARP1LMNAMAPT | |
| SCHEMBL4235369 | 0.82 | CXCR5 (0.49) | ALDH1A1HSD17B10PARP1LMNAMAPT | |
| SCHEMBL21439307 | 0.81 | MAPK8 (0.44) | ALDH1A1HSD17B10PARP1LMNAMAPT | |
| SCHEMBL5481197 | 0.81 | PARP1 (0.40) | ALDH1A1HSD17B10PARP1LMNAMAPT |
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-1615892-A2 | BENZAMIDE 2-HYDROXY-3-DIAMINOALKANES | Elan Pharmaceuticals, Inc. (US) | 2006-01-18 | — | — | EP | disclosed |
| WO-2004094384-A2 | (HETERO) ARYLAMIDE 2-HYDROXY-3-DIAMINOALKANES FOR USE IN THE TREATMENT OF ALZHEIMER’S DISEASE | ELAN PHARMACEUTICALS, INC. (US) | 2004-11-04 | — | — | WO | disclosed |