Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ACLY | P53396 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | ACACA | Q13085 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.31 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 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 | |
|---|---|---|---|---|
| SCHEMBL17274540 | 0.80 | TSHR (0.35) | TSHRALDH1A1CYP2D6CYP2C19HIF1A | |
| SCHEMBL19878626 | 0.78 | TSHR (0.33) | TSHRALDH1A1ACLYCYP2D6CYP2C19 | |
| SCHEMBL29716666 | 0.78 | GRIK1 (0.31) | GRIK1GRIK2 | |
| SCHEMBL23857751 | 0.77 | GRIK1 (0.32) | TSHRALDH1A1GRIK1GRIK2 | |
| SCHEMBL17274527 | 0.75 | TSHR (0.39) | TSHRALDH1A1CYP2D6CYP2C19HIF1A | |
| SCHEMBL11449724 | 0.75 | DGAT1 (0.35) | CTSK | |
| SCHEMBL12372437 | 0.75 | ACLY (0.31) | TSHRALDH1A1ACLYCYP2D6CYP2C19 | |
| SCHEMBL5956546 | 0.74 | — | — | |
| SCHEMBL1696084 | 0.73 | GRIK1 (0.34) | ALDH1A1HIF1AGRIK1GRIK2 | |
| SCHEMBL15179198 | 0.73 | TBXAS1 (0.49) | TSHRACLYACACBACACAKDM4E |
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-4880939-A | ANTISECRETORY AGENTS, HYPOTENSIVES, ANTICOAGULANTS | TORAY INDUSTRIES (JP) | 1989-11-14 | — | — | US | disclosed |
| US-4235930-A | INDUCTION OF MENSTRUATION OR ABORTION | SCHERING, A.G. (DE) | 1980-11-25 | — | — | US | disclosed |