Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | NQO2 | P16083 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 5/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 4/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2018386 | 0.81 | NOTUM (0.43) | NOTUMHTR2AHTR2CCYP19A1NQO2 | |
| SCHEMBL9279199 | 0.80 | NOTUM (0.56) | NOTUMMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL9287309 | 0.73 | NOTUM (0.51) | NOTUMMEN1KMT2ASMN1; SMN2KDM4E | |
| SCHEMBL5774338 | 0.70 | NOTUM (0.41) | NOTUMSMN1; SMN2NPC1GAA | |
| SCHEMBL9259627 | 0.68 | NOTUM (1.00) | NOTUMHTR2AHTR2CMEN1KMT2A | |
| SCHEMBL30615209 | 0.68 | NOTUM (1.00) | NOTUMHTR2AHTR2CMEN1KMT2A | |
| SCHEMBL9261564 | 0.68 | NOTUM (0.57) | NOTUMHTR2AHTR2CMEN1KMT2A | |
| SCHEMBL9264812 | 0.68 | NOTUM (0.57) | NOTUMHTR2AHTR2CCYP19A1SMN1; SMN2 | |
| SCHEMBL26837191 | 0.68 | HTR2A (0.59) | HTR2AHTR2CDRD3KCNH2ALDH1A1 | |
| SCHEMBL13711870 | 0.66 | HTR2A (0.60) | HTR2AHTR2CCYP19A1NQO2DRD3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5428043-A | Tricyclic-cyclic amines as novel cholinesterase inhibitors | PFIZER INC. (US) | 1995-06-27 | — | — | US | disclosed |
| EP-0441517-A2 | Tricyclic amines as novel cholinesterase inhibitors | PFIZER INC. (US) | 1991-08-14 | — | — | EP | disclosed |