Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8675992 | 0.93 | TRPA1 (0.34) | TAAR1SIGMAR1SLC6A2SLC6A4MAOA | |
| SCHEMBL8680653 | 0.90 | SIGMAR1 (0.42) | TAAR1SIGMAR1SLC6A2SLC6A4MAOA | |
| SCHEMBL8675590 | 0.84 | TAAR1 (0.40) | TAAR1SIGMAR1SLC6A2SLC6A4MAOA | |
| SCHEMBL8676228 | 0.79 | — | — | |
| SCHEMBL6348663 | 0.73 | TAAR1 (0.42) | TAAR1SIGMAR1SLC6A2SLC6A4MAOA | |
| SCHEMBL15161841 | 0.73 | SIGMAR1 (0.47) | TAAR1SIGMAR1SLC6A2SLC6A4MAOA | |
| SCHEMBL25381410 | 0.72 | HMGCR (0.32) | — | |
| SCHEMBL44955 | 0.70 | TAAR1 (0.50) | TAAR1SIGMAR1SLC6A2SLC6A4MAOA | |
| SCHEMBL9561371 | 0.70 | SLC7A5 (0.46) | MAPTSLC7A5 | |
| SCHEMBL7965898 | 0.69 | ALDH1A1 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5719096-A | ISOMER BLEND; CROSSLINKING POLYMERS | ELF ATOCHEM NORTH AMERICA, INC. (US) | 1998-02-17 | — | — | US | disclosed |
| US-5539061-A | FOR CROSSLINKING THERMOPLASTIC RESINS, POLYETHYLENE, ETHYLENE-PROPYLENE COPOLYMER | ELF ATOCHEM NORTH AMERICA, INC. (US) | 1996-07-23 | — | — | US | disclosed |