Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 2/20 | 0.35 |
| ▸ | KDM4A | O75164 | 3/20 | 0.33 |
| ▸ | KDM4B | O94953 | 1/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 3/20 | 0.33 |
| ▸ | MAOA | P21397 | 3/20 | 0.33 |
| ▸ | MAOB | P27338 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1458868 | 0.73 | DDB1 (0.32) | TACR1 | |
| SCHEMBL790991 | 0.69 | KDM1A (0.46) | KDM4AKDM4BKDM4CKDM1AMAOA | |
| SCHEMBL10388101 | 0.65 | KDM4A (0.42) | KDM4AKDM4BKDM4CSLC6A2SLC6A4 | |
| SCHEMBL18642602 | 0.63 | MAOB (0.47) | KDM4AKDM4BKDM4CKDM1AMAOA | |
| SCHEMBL8747758 | 0.63 | PNMT (0.56) | MAOAMAOB | |
| SCHEMBL498559 | 0.61 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3MAOAMAOB | |
| SCHEMBL10389478 | 0.61 | DPP4 (0.41) | KDM4AKDM4BKDM4CSLC6A2SLC6A4 | |
| SCHEMBL27917474 | 0.60 | MAOB (0.47) | KDM4AKDM4BKDM4CSLC6A2SLC6A4 | |
| SCHEMBL6053771 | 0.60 | GRIN2D (0.50) | MAOAMAOB | |
| SCHEMBL14446216 | 0.60 | KDM1A (0.41) | TACR1KDM1AMAOAMAOB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011035355-A1 | NOVEL ANTIMALARIAL 3-AZABICYCLO[3.2.2]NONANE DERIVATIVES | UNIVERSITY OF GRAZ (AT) | 2011-03-31 | — | — | WO | disclosed |