Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.37 |
| ▸ | CDC42 | P60953 | 1/20 | 0.37 |
| ▸ | RAC1 | P63000 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.37 |
| ▸ | NCF1 | P14598 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27051691 | 0.82 | NCF1 (0.46) | CYP1A2CYP2A6RAB9ACYP11B1CYP11B2 | |
| SCHEMBL19386736 | 0.82 | CYP1A2 (0.43) | CYP1A2CYP2A6RAB9AABCB11PTGS2 | |
| SCHEMBL13883318 | 0.80 | CYP1A2 (0.41) | CYP1A2CYP2A6RAB9AABCB11AKR1C3 | |
| SCHEMBL13730041 | 0.79 | L3MBTL1 (0.49) | L3MBTL1CYP1A2CYP2A6RAB9AABCB11 | |
| SCHEMBL19388298 | 0.79 | KDM4E (0.49) | CYP1A2CYP2A6RAB9ATSHRCYP11B1 | |
| SCHEMBL18799597 | 0.78 | CYP1A2 (0.34) | L3MBTL1CYP1A2CYP2A6RAB9AABCB11 | |
| SCHEMBL26534221 | 0.77 | L3MBTL1 (0.50) | L3MBTL1CYP1A2CYP2A6RAB9ACYP11B1 | |
| SCHEMBL25873194 | 0.77 | DYRK1A (0.48) | L3MBTL1CYP1A2CYP2A6RAB9AALDH1A1 | |
| SCHEMBL8185328 | 0.76 | L3MBTL1 (0.49) | L3MBTL1CYP1A2CYP2A6RAB9ACYP11B1 | |
| SCHEMBL13830335 | 0.76 | L3MBTL1 (0.49) | L3MBTL1CYP1A2CYP2A6RAB9ACYP11B1 |
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-2021194914-A1 | SUBSTITUTED OXOISOINDOLINE COMPOUNDS FOR THE TREATMENT OF CANCER | BRISTOL-MYERS SQUIBB COMPANY (US) | 2021-09-30 | — | — | WO | disclosed |