Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GLS | O94925 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19920290 | 0.82 | — | — | |
| SCHEMBL20327872 | 0.70 | ALDH1A1 (0.43) | TSHRHPGDSMN1; SMN2ALDH1A1GLS | |
| SCHEMBL19920323 | 0.69 | — | — | |
| SCHEMBL16312929 | 0.68 | TSHR (0.43) | TSHRHPGDALDH1A1 | |
| SCHEMBL5691924 | 0.64 | ALDH1A1 (0.50) | NPC1HPGDRAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL16123443 | 0.64 | CYP2D6 (0.43) | TSHRHPGDSMN1; SMN2 | |
| SCHEMBL21972899 | 0.63 | MEN1 (0.52) | TSHRHPGDSMN1; SMN2ALDH1A1 | |
| SCHEMBL16590582 | 0.61 | SMN1; SMN2 (0.42) | NPC1HPGDRAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL15355916 | 0.60 | — | — | |
| SCHEMBL18469801 | 0.60 | TSHR (0.37) | TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-9938267-B2 | Heterocyclic inhibitors of glutaminase | CALITHERA BIOSCIENCES, INC. (US) | 2018-04-10 | — | — | US | disclosed |