Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | CASP7 | P55210 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 4/20 | 0.48 |
| ▸ | CA1 | P00915 | 4/20 | 0.48 |
| ▸ | CA2 | P00918 | 4/20 | 0.48 |
| ▸ | CA4 | P22748 | 2/20 | 0.48 |
| ▸ | CA5A | P35218 | 2/20 | 0.48 |
| ▸ | CA7 | P43166 | 2/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL17798578 | 1.00 | HSD17B10 (0.50) | HSD17B10CYP2D6THRBTSHRMEN1 | |
| SCHEMBL25633170 | 1.00 | HSD17B10 (0.50) | HSD17B10CYP2D6THRBTSHRMEN1 | |
| SCHEMBL13899513 | 1.00 | HSD17B10 (0.50) | HSD17B10CYP2D6THRBTSHRMEN1 | |
| SCHEMBL27214337 | 1.00 | HSD17B10 (0.50) | HSD17B10CYP2D6THRBTSHRMEN1 | |
| SCHEMBL13942270 | 1.00 | HSD17B10 (0.50) | HSD17B10CYP2D6THRBTSHRMEN1 | |
| SCHEMBL29799426 | 1.00 | HSD17B10 (0.50) | HSD17B10CYP2D6THRBTSHRMEN1 | |
| SCHEMBL21569127 | 0.93 | CYP3A4 (0.45) | HSD17B10CYP2D6THRBTSHRMEN1 | |
| SCHEMBL25634773 | 0.92 | MEN1 (0.42) | HSD17B10CYP2D6THRBMEN1CYP3A4 | |
| SCHEMBL24455470 | 0.91 | CYP2D6 (0.50) | HSD17B10CYP2D6THRBTSHRMEN1 | |
| SCHEMBL29799445 | 0.91 | CYP2D6 (0.50) | HSD17B10CYP2D6THRBTSHRMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3735990-A1 | ANTIBODY DRUG CONJUGATES WITH CELL PERMEABLE BCL-XL INHIBITORS | Abbvie Inc. (US) | 2020-11-11 | — | — | EP | disclosed |