Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL6358539 | 0.83 | ALDH1A1 (0.36) | ALDH1A1CYP1A2HIF1ACHRM2CHRM4 | |
| SCHEMBL6357295 | 0.77 | ALDH1A1 (0.32) | ALDH1A1CYP1A2HIF1ACHRM2CHRM4 | |
| SCHEMBL6357052 | 0.73 | ALDH1A1 (0.36) | ALDH1A1CYP1A2HIF1ACHRM2CHRM4 | |
| SCHEMBL1010827 | 0.72 | SLC6A3 (0.42) | CHRM2CHRM4CHRM3SLC6A2SLC6A4 | |
| SCHEMBL28594691 | 0.71 | ALDH1A1 (0.42) | ALDH1A1CYP1A2HIF1AKMT2ABRD4 | |
| SCHEMBL9730177 | 0.69 | ALDH1A1 (0.46) | ALDH1A1CYP1A2HIF1AKMT2ABRD4 | |
| SCHEMBL9729624 | 0.69 | ALDH1A1 (0.37) | ALDH1A1CYP1A2HIF1ABRD4SLC6A4 | |
| SCHEMBL9729630 | 0.69 | ALDH1A1 (0.37) | ALDH1A1CYP1A2HIF1ABRD4SLC6A4 | |
| SCHEMBL1012159 | 0.68 | CYP1A2 (0.51) | ALDH1A1CYP1A2HIF1ACHRM2CHRM4 | |
| SCHEMBL5405957 | 0.67 | CYP1A2 (0.50) | CYP1A2HIF1AKMT2ABRD4SLC6A4 |
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-0996619-B1 | TROPANE ANALOGS AND METHODS FOR INHIBITION OF MONOAMINE TRANSPORT | ORGANIX INC (US) | 2005-01-05 | — | — | EP | claimed |