Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 3/20 | 0.77 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.77 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.77 |
| ▸ | HTR3B | O95264 | 2/20 | 0.77 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.77 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.77 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.77 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.60 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.60 |
| ▸ | HTR1A | P08908 | 2/20 | 0.56 |
| ▸ | HTR7 | P34969 | 2/20 | 0.56 |
| ▸ | LTA4H | P09960 | 1/20 | 0.56 |
| ▸ | USP2 | O75604 | 4/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | HTR6 | P50406 | 3/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL3066756 | 0.96 | ADRB1 (0.83) | HTR3AADRB1HTR3EHTR3BHTR3D | |
| SCHEMBL17431930 | 0.92 | HTR3A (0.77) | HTR3AADRB1HTR3EHTR3BHTR3D | |
| Phenylpiperazine SCHEMBL27450129 | 0.90 | ADRB1 (0.95) | HTR3AADRB1HTR3EHTR3BHTR3D | |
| SCHEMBL7934360 | 0.90 | ADRB1 (0.95) | HTR3AADRB1HTR3EHTR3BHTR3D | |
| SCHEMBL17423645 | 0.90 | ADRB1 (0.95) | HTR3AADRB1HTR3EHTR3BHTR3D | |
| Phenylpiperazine SCHEMBL3559958 | 0.88 | ADRB1 (0.83) | HTR3AADRB1HTR3EHTR3BHTR3D | |
| Phenylpiperazine SCHEMBL29135595 | 0.88 | ADRB1 (1.00) | HTR3AADRB1HTR3EHTR3BHTR3D | |
| Phenylpiperazine SCHEMBL24889 | 0.88 | ADRB1 (1.00) | HTR3AADRB1HTR3EHTR3BHTR3D | |
| Phenylpiperazine SCHEMBL55125 | 0.88 | ADRB1 (1.00) | HTR3AADRB1HTR3EHTR3BHTR3D | |
| Phenylpiperazine SCHEMBL27858598 | 0.88 | ADRB1 (1.00) | HTR3AADRB1HTR3EHTR3BHTR3D |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016005892-A1 | PROCESS FOR THE PREPARATION OF SUBSTITUTED POLYAZAMACROCYCLES | ENI S.P.A. (IT) | 2016-01-14 | — | — | WO | disclosed |
| WO-2016005892-A1 | PROCESS FOR THE PREPARATION OF SUBSTITUTED POLYAZAMACROCYCLES | ENI S.P.A. (IT) | 2016-01-14 | — | — | WO | disclosed |