Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL7224158 | 1.00 | HTT (0.33) | HTTSMN1; SMN2TSHRMAPTALDH1A1 | |
| SCHEMBL7230876 | 0.93 | HTT (0.31) | HTTSMN1; SMN2TSHRMAPTALDH1A1 | |
| SCHEMBL7230889 | 0.93 | HTT (0.31) | HTTSMN1; SMN2TSHRMAPTALDH1A1 | |
| SCHEMBL7230882 | 0.93 | HTT (0.31) | HTTSMN1; SMN2TSHRMAPTALDH1A1 | |
| SCHEMBL7229299 | 0.90 | SMN1; SMN2 (0.37) | HTTSMN1; SMN2TSHRMAPTALDH1A1 | |
| SCHEMBL7224065 | 0.90 | SIGMAR1 (0.33) | — | |
| SCHEMBL7230613 | 0.85 | CA2 (0.32) | — | |
| SCHEMBL7222456 | 0.85 | SMN1; SMN2 (0.35) | HTTSMN1; SMN2TSHRMAPTALDH1A1 | |
| SCHEMBL7230608 | 0.85 | CA2 (0.32) | — | |
| SCHEMBL7222462 | 0.85 | SMN1; SMN2 (0.35) | HTTSMN1; SMN2TSHRMAPTALDH1A1 |
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-6552226-B1 | Rapid; low temperature; one pot synthesis; reduced catalytic quantities of such as lewis acid and tertiary amine; entiomerically pure products | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2003-04-22 | — | — | US | disclosed |