Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 13/20 | 0.47 |
| ▸ | MAOA | P21397 | 12/20 | 0.47 |
| ▸ | MAOB | P27338 | 12/20 | 0.47 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL4989697 | 0.87 | KDM1A (0.45) | KDM1AMAOAMAOBSLC18A3TRPA1 | |
| SCHEMBL11848620 | 0.86 | KDM1A (0.40) | KDM1AMAOAMAOBSLC18A3TRPA1 | |
| Hydrochloric Acid SCHEMBL27656059 | 0.86 | KDM1A (0.46) | KDM1AMAOAMAOBSLC18A3TRPA1 | |
| SCHEMBL11842055 | 0.84 | SLC6A2 (0.38) | SLC18A3TRPA1TSHR | |
| SCHEMBL11849747 | 0.78 | TSHR (0.38) | KDM1ASLC18A3TRPA1TSHR | |
| SCHEMBL28766998 | 0.75 | SLC18A3 (0.55) | KDM1AMAOAMAOBSLC18A3TRPA1 | |
| SCHEMBL10407205 | 0.75 | KDM1A (0.36) | KDM1AMAOAMAOBSLC18A3TRPA1 | |
| SCHEMBL11847960 | 0.75 | CYP3A4 (0.39) | TSHR | |
| SCHEMBL8323357 | 0.74 | TSHR (0.45) | KDM1AMAOAMAOBSLC18A3TRPA1 | |
| SCHEMBL15539716 | 0.74 | TRPA1 (0.43) | KDM1AMAOAMAOBSLC18A3TRPA1 |
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-7273952-B2 | Substituted C-cyclohexylmethylamine derivatives | GRUENENTHAL GMBH (DE) | 2007-09-25 | — | — | US | disclosed |