Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.37 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.37 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 3/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.36 |
| ▸ | ACLY | P53396 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23320473 | 0.86 | CYP19A1 (0.41) | ALDH1A1ROCK2HPGD | |
| SCHEMBL23320561 | 0.83 | ALDH1A1 (0.39) | ALDH1A1LMNATDP1GRIK1GRIK2 | |
| SCHEMBL23320489 | 0.81 | CHEK1 (0.37) | ALDH1A1ROCK2 | |
| SCHEMBL23320493 | 0.81 | ALDH1A1 (0.38) | ALDH1A1LMNATDP1GRIK1GRIK2 | |
| SCHEMBL23320490 | 0.76 | ALOX5 (0.38) | ALDH1A1LMNAACLY | |
| SCHEMBL23320474 | 0.76 | PTGES2 (0.36) | — | |
| SCHEMBL976929 | 0.71 | PTGER4 (0.53) | ALDH1A1GRIK1GRIK2PTGER4MTNR1A | |
| SCHEMBL24042574 | 0.70 | NAMPT (0.54) | ROCK2 | |
| SCHEMBL30943269 | 0.70 | NAMPT (0.54) | ROCK2 | |
| SCHEMBL21812459 | 0.70 | AAK1 (0.51) | ALDH1A1LMNATDP1GRIK1GRIK2 |
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-3818053-A1 | FUSED RING COMPOUND HAVING UREA STRUCTURE | Sanford Burnham Prebys Medical Discovery Institute (US) | 2021-05-12 | — | — | EP | disclosed |