Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 3/20 | 0.35 |
| ▸ | BACE1 | P56817 | 3/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.32 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.32 |
| ▸ | NSD2 | O96028 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 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 | |
|---|---|---|---|---|
| SCHEMBL9733783 | 0.89 | HTR1A (0.36) | HTR1AALDH1A1LMNATSHRPGR | |
| SCHEMBL9733284 | 0.86 | HTR1A (0.37) | HTR1AALDH1A1PGRBACE1GABRA1 | |
| SCHEMBL9733608 | 0.82 | HTR1A (0.36) | HTR1AALDH1A1PGRBACE1CCNB2 | |
| SCHEMBL9733278 | 0.81 | PGR (0.36) | HTR1AALDH1A1PGRBACE1 | |
| SCHEMBL9737787 | 0.79 | F10 (0.39) | ALDH1A1 | |
| SCHEMBL9589614 | 0.79 | ABCC9 (0.38) | HTR1APGRGABRA1GABRG2GABRB3 | |
| SCHEMBL9733561 | 0.77 | PGR (0.36) | HTR1AALDH1A1PGRBACE1NSD2 | |
| SCHEMBL8088666 | 0.77 | CASP3 (0.34) | HTR1APGRELANECASP3 | |
| SCHEMBL8085392 | 0.76 | HTR1A (0.35) | HTR1APGR | |
| SCHEMBL9732955 | 0.75 | CYP19A1 (0.44) | HTR1AGABRA1GABRG2GABRB3GABRA5 |
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 |
|---|---|---|---|---|---|---|---|
| US-5132307-A | TETRALIN COMPOUNDS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-07-21 | — | — | US | disclosed |
| EP-0368160-A1 | Tetralin derivatives | MERCK PATENT GmbH (DE) | 1990-05-16 | — | — | EP | disclosed |