Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.34 |
| ▸ | CHRNG | P07510 | 1/20 | 0.34 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.34 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | CHRND | Q07001 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20153621 | 0.90 | MEN1 (0.36) | GAAALDH1A1CA12CA1CA2 | |
| SCHEMBL20131503 | 0.77 | CA12 (0.32) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL20131490 | 0.77 | MEN1 (0.35) | GAAALDH1A1CA12CA1CA2 | |
| SCHEMBL20131461 | 0.74 | RORC (0.39) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL22297669 | 0.72 | HSD17B1 (0.45) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL22297671 | 0.72 | HSD17B1 (0.45) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL22297656 | 0.72 | HSD17B1 (0.45) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL30636993 | 0.64 | HTR2A (0.49) | HPGDCA12CA1CA2CA9 | |
| SCHEMBL6081536 | 0.61 | MAPT (0.47) | GAAALDH1A1HPGDSLC6A4SLC6A3 | |
| SCHEMBL16306571 | 0.59 | PPM1B (0.40) | ALDH1A1CA12CA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018089402-A1 | TRICYCLIC SULFONES AS ROR GAMMA MODULATORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-05-17 | — | — | WO | disclosed |