Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 6/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.37 |
| ▸ | CNR2 | P34972 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | FPR1 | P21462 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15660455 | 0.73 | FAAH (0.39) | CNR2ALDH1A1TSHRHTTFAAH | |
| SCHEMBL2011805 | 0.71 | FAAH (0.38) | ALDH1A1TSHRHTTFAAHFPR1 | |
| SCHEMBL6901641 | 0.67 | KCNH2 (0.41) | SIGMAR1ALDH1A1TSHRLMNA | |
| SCHEMBL20091630 | 0.67 | CYP3A4 (0.40) | SIGMAR1ALDH1A1TSHRLMNA | |
| SCHEMBL8877389 | 0.66 | KEAP1 (0.41) | HSD11B1SIGMAR1CNR2ALDH1A1TSHR | |
| SCHEMBL8875969 | 0.66 | KEAP1 (0.41) | HSD11B1SIGMAR1CNR2ALDH1A1TSHR | |
| SCHEMBL2486157 | 0.64 | CYP3A4 (0.39) | SIGMAR1ALDH1A1TSHRLMNA | |
| SCHEMBL11679024 | 0.64 | CYP3A4 (0.39) | SIGMAR1ALDH1A1TSHRLMNA | |
| SCHEMBL20524855 | 0.64 | SIGMAR1 (0.38) | HSD11B1SIGMAR1ALDH1A1LMNAFPR1 | |
| SCHEMBL8876593 | 0.64 | KEAP1 (0.39) | HSD11B1CNR2ALDH1A1HTTLMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110662753-A | Cross-coupling reaction catalysts and methods of making and using the same | 耶鲁大学 | 2020-01-07 | — | — | CN | claimed |
| CN-106795191-B | Novel precatalyst scaffolds for crosslinking reactions and methods of making and using same | 耶鲁大学 | 2020-07-03 | — | — | CN | disclosed |
| CN-111282598-A | Novel precatalyst scaffolds for crosslinking reactions and methods of making and using same | 耶鲁大学 | 2020-06-16 | — | — | CN | disclosed |
| CN-110662753-A | Cross-coupling reaction catalysts and methods of making and using the same | 耶鲁大学 | 2020-01-07 | — | — | CN | disclosed |