Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.35 |
| ▸ | MRGPRX2 | Q96LB1 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | HRH2 | P25021 | 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 | |
|---|---|---|---|---|
| SCHEMBL8713422 | 0.87 | CASR (0.39) | CASRCXCR1 | |
| SCHEMBL8718475 | 0.85 | MAOB (0.48) | SMN1; SMN2RAB9ANPC1LTA4HHIF1A | |
| SCHEMBL8714023 | 0.81 | TRPA1 (0.46) | ESR1ESR2KDM4ESMN1; SMN2HIF1A | |
| SCHEMBL8713802 | 0.79 | KIF11 (0.44) | ESR1ESR2KDM4EMEN1KMT2A | |
| SCHEMBL8713320 | 0.79 | ESR1 (0.38) | ESR1ESR2ALDH1A1HTTHIF1A | |
| SCHEMBL8714231 | 0.79 | ESR1 (0.53) | ESR1ESR2ALDH1A1TRPA1 | |
| SCHEMBL8716608 | 0.79 | KIF11 (0.44) | ESR1ESR2MEN1KMT2AHIF1A | |
| SCHEMBL8715390 | 0.77 | KIF11 (0.46) | MEN1KMT2AHIF1AKCNH2OPRM1 | |
| SCHEMBL8716258 | 0.76 | SLC6A4 (0.44) | ESR1ESR2CASRRAB9ANPC1 | |
| SCHEMBL8719185 | 0.76 | KIF11 (0.43) | ALDH1A1HIF1A |
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-5811293-A | CULTURE PRODUCT AS CHEMICAL INTERMEDIATE FOR ANTI-OBESITY AGENT | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 1998-09-22 | — | — | US | disclosed |