Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.42 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GMNN | O75496 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 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 | |
|---|---|---|---|---|
| SCHEMBL8349013 | 0.83 | TSHR (0.45) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL2961735 | 0.83 | TSHR (0.45) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL17682919 | 0.82 | TSHR (0.43) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL13816225 | 0.82 | TSHR (0.43) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL20373431 | 0.80 | TSHR (0.42) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL11490543 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL78555 | 0.79 | CA1 (0.62) | ALDH1A1TSHRRAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL2425317 | 0.79 | CA1 (0.62) | ALDH1A1TSHRRAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL11490546 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL78556 | 0.79 | CA1 (0.62) | ALDH1A1TSHRRAB9AKDM4ESMN1; SMN2 |
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-20200401046-A1 | AN ETHYNYL DERIVED COMPOSITE, A COMPOSITION COMPRISING THEREOF, A METHOD FOR MANUFACTURING A COATING BY IT, AND A METHOD FOR MANUFACTURING A DEVICE COMPRISING THE COATING | MERCK PATENT GMBH (DE) | 2020-12-24 | — | — | US | disclosed |
| EP-2197842-B1 | 2, 3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS | SCHERING CORP (US) | 2012-05-23 | — | — | EP | disclosed |