Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.74 |
| ▸ | ATM | Q13315 | 1/20 | 0.74 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.73 |
| ▸ | POLB | P06746 | 2/20 | 0.73 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.72 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.72 |
| ▸ | TSHR | P16473 | 3/20 | 0.64 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.64 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.63 |
| ▸ | RAB9A | P51151 | 1/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.59 |
| ▸ | GLA | P06280 | 1/20 | 0.58 |
| ▸ | USP2 | O75604 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL20437921 | 0.88 | KMT2A (0.94) | KMT2AATMKDM4EPOLBCYP2D6 | |
| SCHEMBL7953122 | 0.82 | TSHR (0.85) | KMT2AATMKDM4EPOLBCYP2D6 | |
| SCHEMBL22640122 | 0.82 | TSHR (0.85) | KMT2AATMKDM4EPOLBCYP2D6 | |
| SCHEMBL22639925 | 0.80 | TSHR (0.88) | KMT2AATMKDM4EPOLBCYP2D6 | |
| SCHEMBL10200142 | 0.80 | TSHR (0.88) | KMT2AATMKDM4EPOLBCYP2D6 | |
| SCHEMBL10982797 | 0.79 | ATM (0.85) | KMT2AATMKDM4EPOLBCYP2D6 | |
| SCHEMBL22639683 | 0.79 | ATM (0.85) | KMT2AATMKDM4EPOLBCYP2D6 | |
| SCHEMBL7953079 | 0.79 | ATM (0.85) | KMT2AATMKDM4EPOLBCYP2D6 | |
| SCHEMBL14020065 | 0.79 | ATM (0.85) | KMT2AATMKDM4EPOLBCYP2D6 | |
| SCHEMBL4580390 | 0.79 | CYP2D6 (1.00) | KMT2AATMKDM4EPOLBCYP2D6 |
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-6239313-B1 | FROM AN INCLUSION COMPLEX OF EPOXIDE WITH CYCLODEXTRIN AND NUCLEOPHILIC COMPOUND | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2001-05-29 | — | — | US | disclosed |