Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.53 |
| ▸ | LMNA | P02545 | 7/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 9/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7223622 | 0.87 | ALDH1A1 (0.49) | ALDH1A1LMNASMN1; SMN2HPGDNPC1 | |
| SCHEMBL7223759 | 0.86 | ALDH1A1 (0.49) | ALDH1A1LMNASMN1; SMN2HPGDNPC1 | |
| SCHEMBL7217353 | 0.84 | HPGD (0.38) | ALDH1A1LMNAHPGDRAB9AMAPT | |
| SCHEMBL7219589 | 0.84 | NLRP3 (0.37) | ALDH1A1LMNAHPGDRAB9AMAPT | |
| SCHEMBL7217184 | 0.84 | ALDH1A1 (0.47) | ALDH1A1LMNASMN1; SMN2HPGDNPC1 | |
| SCHEMBL11421509 | 0.83 | ALDH1A1 (0.62) | ALDH1A1LMNASMN1; SMN2HPGDNPC1 | |
| SCHEMBL30502814 | 0.81 | NLRP3 (0.56) | ALDH1A1LMNASMN1; SMN2HTTMAPT | |
| SCHEMBL5941054 | 0.81 | NLRP3 (0.56) | ALDH1A1LMNASMN1; SMN2HTTMAPT | |
| SCHEMBL7223666 | 0.80 | SMN1; SMN2 (0.41) | ALDH1A1LMNASMN1; SMN2HPGDNPC1 | |
| SCHEMBL7223947 | 0.77 | SMN1; SMN2 (0.49) | ALDH1A1LMNASMN1; SMN2HPGDHTT |
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-6521603-B2 | Amide, thioamide, amidine and thioester derivatives containing a benzene, pyridine, thiophene, furan, pyrrole, pyrazole, thiazole or isothiazole ring | MONSANTO TECHNOLOGY LLC | 2003-02-18 | — | — | US | claimed |