Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.35 |
| ▸ | LDHB | P07195 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1790076 | 0.78 | ALDH1A1 (0.35) | — | |
| SCHEMBL1790074 | 0.78 | ALDH1A1 (0.35) | — | |
| SCHEMBL20843720 | 0.74 | LDHA (0.37) | LDHALDHBACHE | |
| SCHEMBL10642087 | 0.72 | LDHA (0.35) | LDHALDHBACHE | |
| SCHEMBL124489 | 0.71 | CA2 (0.30) | — | |
| SCHEMBL20043784 | 0.70 | MAPT (0.47) | ACHE | |
| SCHEMBL20042555 | 0.70 | — | — | |
| SCHEMBL21001300 | 0.70 | LMNA (0.35) | LDHALDHBACHE | |
| SCHEMBL7567060 | 0.70 | LMNA (0.35) | LDHALDHBACHE | |
| Trifluoroacetamide SCHEMBL5568582 | 0.69 | LDHA (0.44) | LDHALDHBACHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019052935-A1 | ORGANIC SEMICONDUCTING COMPOUNDS | MERCK PATENT GMBH (DE) | 2019-03-21 | — | — | WO | disclosed |
| WO-2018065350-A1 | ORGANIC SEMICONDUCTING COMPOUNDS | MERCK PATENT GMBH (DE) | 2018-04-12 | — | — | WO | disclosed |