Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.40 |
| ▸ | NPY1R | P25929 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPY2R | P49146 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28849444 | 1.00 | TRPA1 (0.45) | TRPA1CNR2OPRM1OPRL1MEN1 | |
| SCHEMBL28849419 | 0.85 | TRPA1 (0.58) | TRPA1CNR2OPRM1MEN1KMT2A | |
| SCHEMBL5204638 | 0.78 | OPRM1 (0.47) | CNR2OPRM1OPRL1MEN1KMT2A | |
| SCHEMBL5204648 | 0.78 | CNR2 (0.41) | CNR2OPRM1OPRL1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL4864830 | 0.78 | OPRM1 (0.47) | CNR2OPRM1OPRL1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL4864833 | 0.77 | CNR2 (0.41) | CNR2OPRM1OPRL1MEN1KMT2A | |
| SCHEMBL28849438 | 0.76 | MAPT (0.42) | TRPA1CNR2OPRM1MEN1KMT2A | |
| SCHEMBL5205111 | 0.74 | SLC6A4 (0.64) | OPRM1OPRL1MEN1KMT2ASLC6A9 | |
| SCHEMBL5206248 | 0.74 | SLC22A1 (0.60) | CNR2OPRM1OPRL1MEN1KMT2A | |
| SCHEMBL898941 | 0.74 | SLC6A2 (0.49) | CNR2OPRM1MEN1KMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115108875-B | Nitrogen-containing heteroarene chiral cyclic alcohol constructed by asymmetric catalysis of visible light, and preparation method and application thereof | 河南师范大学 | 2023-07-04 | — | — | CN | disclosed |
| CN-115108875-A | Nitrogen-containing heteroarene chiral cyclic alcohol constructed by visible light asymmetric catalysis, and preparation method and application thereof | 河南师范大学 | 2022-09-27 | — | — | CN | disclosed |