Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3389160 | 0.81 | TSHR (0.48) | ALDH1A1PKMMAPTHSD17B10NPSR1 | |
| SCHEMBL3392823 | 0.70 | MAPT (0.47) | ALDH1A1GLAMAPTKMT2AKDM4E | |
| SCHEMBL1707681 | 0.69 | KMT2A (0.79) | ALDH1A1GLAPKMLMNAMAPT | |
| SCHEMBL23274312 | 0.67 | ALDH1A1 (0.48) | ALDH1A1GLAPKMLMNAMAPT | |
| SCHEMBL23274310 | 0.67 | ALDH1A1 (0.48) | ALDH1A1GLAPKMLMNAMAPT | |
| SCHEMBL23274725 | 0.67 | ALDH1A1 (0.48) | ALDH1A1GLAPKMLMNAMAPT | |
| SCHEMBL15830273 | 0.66 | ALDH1A1 (0.68) | ALDH1A1GLAPKMLMNAMAPT | |
| SCHEMBL11960321 | 0.66 | KMT2A (0.64) | ALDH1A1GLAPKMLMNAMAPT | |
| SCHEMBL3392632 | 0.65 | RAC1 (0.58) | LMNAMAPTCACNA2D1 | |
| SCHEMBL15830338 | 0.64 | ALDH1A1 (0.64) | ALDH1A1GLAPKMLMNAMAPT |
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-2241555-A1 | New RAC1 inhibitors as potential pharmacological agents for heart failure treatment | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2010-10-20 | — | — | EP | claimed |
| EP-2241555-A1 | New RAC1 inhibitors as potential pharmacological agents for heart failure treatment | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2010-10-20 | — | — | EP | disclosed |