Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL20179720 | 0.76 | GPR88 (0.35) | TSHRGAANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL20179716 | 0.74 | GPR88 (0.34) | TSHRGAANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL20179589 | 0.65 | POLB (0.53) | TSHRGAANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL1107021 | 0.64 | GAA (0.62) | TSHRGAANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL24805790 | 0.64 | MAPT (0.57) | TSHRGAANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL20179492 | 0.64 | SMN1; SMN2 (0.58) | TSHRGAANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL10253878 | 0.63 | GAA (0.60) | TSHRGAANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL20363266 | 0.62 | GAA (0.63) | TSHRGAANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL17712437 | 0.62 | GAA (0.61) | TSHRGAANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL20179509 | 0.61 | KMT2A (0.45) | ALDH1A1SMN1; SMN2HPGDCTSKLMNA |
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-2018093695-A1 | FACTOR XIIa INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2018-05-24 | — | — | WO | disclosed |