Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HMGCR | P04035 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | ACLY | P53396 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | ACACA | Q13085 | 1/20 | 0.35 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | CPT2 | P23786 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL243901 | 0.97 | TSHR (0.43) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| Acetic Acid SCHEMBL1695867 | 0.94 | TSHR (0.42) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| SCHEMBL25269996 | 0.77 | TSHR (0.46) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| SCHEMBL83915 | 0.77 | TSHR (0.60) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| SCHEMBL9015652 | 0.77 | ALDH1A1 (0.37) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| Hydrochloric Acid SCHEMBL4137653 | 0.77 | TSHR (0.60) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| SCHEMBL15074875 | 0.76 | TET2 (0.43) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| SCHEMBL17520809 | 0.75 | ALDH1A1 (0.33) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL10868076 | 0.74 | TSHR (0.57) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| SCHEMBL14879687 | 0.74 | TSHR (0.43) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4990363-A | Decomposing organometallic compound using glow discharges | SCHERING AKTIENGESELLSCHAFT (DE) | 1991-02-05 | — | — | US | disclosed |