Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | GCGR | P47871 | 1/20 | 0.36 |
| ▸ | DCLRE1B | Q9H816 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL27308477 | 0.83 | CLCN2 (0.54) | TSHRCYP1A2SMN1; SMN2CASP1CLCN2 | |
| SCHEMBL19116173 | 0.82 | TSHR (0.41) | TSHRCYP1A2SMN1; SMN2CASP1CLCN2 | |
| SCHEMBL19115960 | 0.82 | KDM4E (0.38) | TSHRCYP1A2SMN1; SMN2CASP1CLCN2 | |
| SCHEMBL217628 | 0.82 | TSHR (0.61) | TSHRCYP1A2SMN1; SMN2CASP1ALDH1A1 | |
| SCHEMBL32690872 | 0.82 | TSHR (0.61) | TSHRCYP1A2SMN1; SMN2CASP1ALDH1A1 | |
| SCHEMBL6966009 | 0.82 | TSHR (0.44) | TSHRCYP1A2SMN1; SMN2CASP1CLCN2 | |
| SCHEMBL28204201 | 0.82 | TSHR (0.59) | TSHRSMN1; SMN2CLCN2ALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL28243602 | 0.82 | CLCN2 (0.53) | TSHRCYP1A2SMN1; SMN2CASP1CLCN2 | |
| SCHEMBL522436 | 0.79 | APOBEC3G (0.36) | TSHRSMN1; SMN2ALDH1A1KDM4EMAPT | |
| SCHEMBL16077689 | 0.78 | MAPT (0.44) | TSHRALDH1A1MEN1KMT2AKDM4E |
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-2415742-A1 | METHOD FOR PRODUCING ALCOHOL COMPOUND AND CATALYST THEREFOR | Sumitomo Chemical Company, Limited (JP) | 2012-02-08 | — | — | EP | disclosed |