Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DEPTOR | Q8TB45 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MMP2 | P08253 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29596251 | 1.00 | DEPTOR (0.46) | DEPTORKMT2AMEN1IDO1RAB9A | |
| SCHEMBL29597278 | 0.81 | DEPTOR (0.47) | DEPTORKMT2AMEN1IDO1RAB9A | |
| SCHEMBL1946324 | 0.81 | DEPTOR (0.47) | DEPTORKMT2AMEN1IDO1RAB9A | |
| SCHEMBL28765244 | 0.81 | DEPTOR (0.47) | DEPTORKMT2AMEN1IDO1RAB9A | |
| SCHEMBL28765243 | 0.80 | GAA (0.47) | DEPTORKMT2AMEN1IDO1RAB9A | |
| SCHEMBL32681965 | 0.80 | GAA (0.47) | DEPTORKMT2AMEN1IDO1RAB9A | |
| SCHEMBL28765241 | 0.79 | DEPTOR (0.43) | DEPTORKMT2AMEN1RAB9ANPC1 | |
| SCHEMBL22968440 | 0.79 | DEPTOR (0.43) | DEPTORKMT2AMEN1IDO1RAB9A | |
| SCHEMBL29711857 | 0.79 | DEPTOR (0.43) | DEPTORKMT2AMEN1IDO1RAB9A | |
| SCHEMBL29711832 | 0.79 | DEPTOR (0.43) | DEPTORKMT2AMEN1RAB9ANPC1 |
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-114555603-A | Improved synthesis for the preparation of (2H-1,2, 3-triazol-2-yl) phenyl compounds as orexin receptor modulators | 詹森药业有限公司 | 2022-05-27 | — | — | CN | disclosed |
| WO-2021023843-A1 | IMPROVED SYNTHETIC METHODS OF MAKING (2H-1,2,3-TRIAZOL-2-YL)PHENYL COMPOUNDS AS OREXIN RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2021-02-11 | — | — | WO | disclosed |