Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UBE2D3 | P61077 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.32 |
| ▸ | RNASE1 | P07998 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18180933 | 0.80 | ABCB1 (0.36) | UBE2D3NLRP3BCHEABCB1 | |
| SCHEMBL18180918 | 0.72 | MEN1 (0.33) | MEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL18180869 | 0.70 | UBE2D3 (0.43) | UBE2D3MEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL18180915 | 0.68 | MEN1 (0.32) | MEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL5119542 | 0.61 | RAB9A (0.61) | BCHERAB9AKDM4ENPC1SMN1; SMN2 | |
| SCHEMBL16311866 | 0.61 | CHRM2 (0.56) | MEN1KMT2ABCHE | |
| SCHEMBL12653017 | 0.60 | CHRM2 (0.44) | BCHE | |
| SCHEMBL20897888 | 0.58 | CHRM2 (0.50) | BCHEHSP90AB1 | |
| SCHEMBL20503243 | 0.58 | CHRM2 (0.50) | BCHEHSP90AB1 | |
| SCHEMBL8183692 | 0.57 | GAA (0.58) | MEN1KMT2ABCHEABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016169573-A1 | SESQUITERPENE LACTONES AS POTENT AND BROAD SPECTRUM ANTIVIRAL COMPOUNDS AGAINST ALL GENOTYPES OF HEPATITIS C VIRUS (HCV) | ELSEBAI MAHMOUD FAHMI (EG) | 2016-10-27 | — | — | WO | disclosed |