Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.72 |
| ▸ | HTR3B | O95264 | 1/20 | 0.72 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.72 |
| ▸ | HTR3A | P46098 | 1/20 | 0.72 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.72 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.72 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.72 |
| ▸ | USP2 | O75604 | 5/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.58 |
| ▸ | TSHR | P16473 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.55 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.55 |
| ▸ | HTR6 | P50406 | 2/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.52 |
| ▸ | HTR7 | P34969 | 1/20 | 0.52 |
| ▸ | LTA4H | P09960 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Pyrrolidine SCHEMBL28859475 | 0.98 | HTR3E (0.69) | HTR3EHTR3BADRB1HTR3AHTR3D | |
| Piperidine SCHEMBL27934131 | 0.98 | HTR3E (0.69) | HTR3EHTR3BADRB1HTR3AHTR3D | |
| SCHEMBL3066756 | 0.89 | ADRB1 (0.83) | HTR3EHTR3BADRB1HTR3AHTR3D | |
| Phenylpiperazine SCHEMBL3559958 | 0.89 | ADRB1 (0.83) | HTR3EHTR3BADRB1HTR3AHTR3D | |
| Chlorobenzene SCHEMBL8165726 | 0.89 | HTR3E (0.58) | HTR3EHTR3BADRB1HTR3AHTR3D | |
| Piperidine SCHEMBL28077622 | 0.86 | HTR3E (0.55) | HTR3EHTR3BADRB1HTR3AHTR3D | |
| SCHEMBL12485 | 0.86 | L3MBTL1 (0.61) | HTR3EHTR3BADRB1HTR3AHTR3D | |
| SCHEMBL18228234 | 0.86 | L3MBTL1 (0.61) | HTR3EHTR3BADRB1HTR3AHTR3D | |
| SCHEMBL17423643 | 0.86 | HTR3A (0.77) | HTR3EHTR3BADRB1HTR3AHTR3D | |
| SCHEMBL17431930 | 0.86 | HTR3A (0.77) | HTR3EHTR3BADRB1HTR3AHTR3D |
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-2598111-A2 | SKIN CARE COMPOSITIONS COMPRISING SUBSTITUTED DIAMINES | Unilever PLC (GB) | 2013-06-05 | — | — | EP | disclosed |
| WO-2012013417-A2 | SKIN CARE COMPOSITIONS COMPRISING SUBSTITUTED DIAMINES | UNILEVER PLC (GB) | 2012-02-02 | — | — | WO | disclosed |