Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | HTR2C | P28335 | 3/20 | 0.38 |
| ▸ | HTR2B | P41595 | 3/20 | 0.38 |
| ▸ | HTR3A | P46098 | 3/20 | 0.36 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.36 |
| ▸ | HTR3B | O95264 | 1/20 | 0.36 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.36 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.36 |
| ▸ | HTR5A | P47898 | 4/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 4/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.33 |
| ▸ | HTR1D | P28221 | 2/20 | 0.33 |
| ▸ | HTR7 | P34969 | 2/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.32 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
| ▸ | CMA1 | P23946 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3654837 | 0.84 | HTR2A (0.38) | HTR2AHTR2CHTR2BHTR3AHTR3E | |
| SCHEMBL3657236 | 0.72 | DRD1 (0.41) | HTR5AACHEDRD4ADRA2AMETAP1 | |
| SCHEMBL5872563 | 0.71 | HTR2A (0.36) | HTR2AHTR2CHTR2BHTR3AHTR3E | |
| SCHEMBL3657574 | 0.68 | DRD2 (0.35) | DRD4DRD2 | |
| SCHEMBL29531917 | 0.68 | HTR2A (0.38) | HTR2AHTR2CHTR2BHTR3AHTR3E | |
| SCHEMBL10969836 | 0.68 | HTR2A (0.38) | HTR2AHTR2CHTR2BHTR3AHTR3E | |
| SCHEMBL31758052 | 0.67 | PNMT (0.43) | HTR2AHTR2CHTR2BHTR3AHTR3E | |
| SCHEMBL207169 | 0.66 | TP53 (0.35) | ACHEAHRKDM4EMEN1NPC1 | |
| SCHEMBL3649471 | 0.65 | CTSD (0.42) | HTR2AHTR2CHTR2BHTR3AHTR3E | |
| SCHEMBL3651633 | 0.64 | HTR5A (0.36) | HTR5A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2215067-A1 | AMINO-HETEROARYL-CONTAINING PROKINETICIN 1 RECEPTOR ANTAGONISTS | Janssen Pharmaceutica, N.V. (BE) | 2010-08-11 | — | — | EP | claimed |
| WO-2009058653-A1 | AMINO-HETEROARYL-CONTAINING PROKINETICIN 1 RECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA N.V. (BE) | 2009-05-07 | — | — | WO | claimed |