Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.31 |
| ▸ | MIF | P14174 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28143174 | 0.92 | LMNA (0.48) | LMNAADRA2AADRA2CHIF1AKDM4E | |
| Ethylene SCHEMBL29258943 | 0.88 | ALDH1A1 (0.46) | LMNAADRA2AADRA2CHIF1AKDM4E | |
| Ethylene SCHEMBL29258942 | 0.88 | — | — | |
| SCHEMBL13208844 | 0.78 | — | — | |
| SCHEMBL8227653 | 0.78 | — | — | |
| SCHEMBL15047 | 0.78 | — | — | |
| Benzene SCHEMBL27917933 | 0.77 | LMNA (0.43) | LMNAADRA2AADRA2CHIF1AKDM4E | |
| Benzene SCHEMBL5919597 | 0.75 | ADRA2A (0.41) | LMNAADRA2AADRA2CHIF1AKDM4E | |
| Biphenyl SCHEMBL28807835 | 0.74 | ADRA2A (0.54) | LMNAADRA2AADRA2CHIF1AKDM4E | |
| SCHEMBL9165684 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-3984360-A | Lead-free sprayable polyurethane system and rigid cellular products | WITCO CHEMICAL CORPORATION (US) | 1976-10-05 | — | — | US | disclosed |