Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.50 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.48 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.44 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.44 |
| ▸ | CDC7 | O00311 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | GRN | P28799 | 1/20 | 0.39 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL31284789 | 0.78 | TOP2A (0.48) | CYP19A1KDM4EALDH1A1ALOX15 | |
| SCHEMBL15875591 | 0.77 | HSD11B1 (0.51) | P2RX7HSD11B1GRM2SLC9A1CDC7 | |
| SCHEMBL11563985 | 0.77 | P2RX7 (0.50) | P2RX7HSD11B1GRM2SLC9A1CDC7 | |
| SCHEMBL1371186 | 0.77 | KDM4E (0.54) | P2RX7HSD11B1GRM2SLC9A1CDC7 | |
| SCHEMBL4195851 | 0.76 | HSD11B1 (0.61) | P2RX7HSD11B1GRM2SLC9A1CDC7 | |
| SCHEMBL2895467 | 0.76 | CDC7 (0.61) | P2RX7HSD11B1GRM2SLC9A1CDC7 | |
| SCHEMBL27855037 | 0.74 | HSD11B1 (0.56) | P2RX7HSD11B1GRM2SLC9A1CDC7 | |
| SCHEMBL18359857 | 0.74 | HSD11B1 (0.56) | P2RX7HSD11B1GRM2SLC9A1CDC7 | |
| SCHEMBL18354111 | 0.74 | HSD11B1 (0.52) | P2RX7HSD11B1GRM2SLC9A1CDC7 | |
| SCHEMBL23336762 | 0.73 | HSD11B1 (0.55) | P2RX7HSD11B1CDC7ALDH1A1IDO1 |
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-108640880-A | The synthetic method of 1- alkyl -5- aryl -1,2,3- triazole compounds | 河南师范大学 | 2018-10-12 | — | — | CN | claimed |
| CN-108640879-A | The synthetic method of 1- alkyl -5- alkynyl -1,2,3- triazole compounds | 河南师范大学 | 2018-10-12 | — | — | CN | claimed |
| CN-108503601-A | The synthetic method of 1- alkyl -5- arylthio -1,2,3- triazole compounds | 河南师范大学 | 2018-09-07 | — | — | CN | claimed |
| CN-108358857-A | The synthetic method of 1- alkyl -5- aryloxy group -1,2,3- triazole compounds | 河南师范大学 | 2018-08-03 | — | — | CN | claimed |