Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | PDE2A | O00408 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 0.41 |
| ▸ | HTR2B | P41595 | 2/20 | 0.41 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.41 |
| ▸ | HTR3B | O95264 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 1/20 | 0.41 |
| ▸ | HTR1E | P28566 | 1/20 | 0.41 |
| ▸ | HTR1F | P30939 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15082534 | 0.86 | HSD17B3 (0.51) | GPR55ALOX15PDE2AMAOACNR2 | |
| SCHEMBL12433441 | 0.82 | POLB (0.57) | ESR2MAPTNPSR1POLBHSD17B3 | |
| SCHEMBL12414854 | 0.82 | MAOA (0.58) | MAOADYRK1AKDM4EALDH1A1GLA | |
| SCHEMBL15085003 | 0.78 | KDM4E (0.52) | TSHRMAOAMAPTNPSR1KDM4E | |
| SCHEMBL15082532 | 0.71 | LMNA (0.59) | ALOX15TSHRMAOAMAPTKDM4E | |
| SCHEMBL8934512 | 0.70 | GPR55 (0.82) | GPR55TSHRCNR2MAPTPOLB | |
| SCHEMBL7103988 | 0.69 | MTNR1A (0.57) | HTR1AHTR2AHTR2CHTR2BHTR3E | |
| SCHEMBL30311162 | 0.68 | MMP2 (0.60) | CYP1A2TSHRMAOAMAPTPOLB | |
| Bromide SCHEMBL7245774 | 0.68 | MTNR1A (0.56) | HTR1AHTR2AHTR2CHTR2BHTR3E | |
| Hydrochloric Acid SCHEMBL15661933 | 0.68 | MTNR1A (0.56) | HTR1AHTR2AHTR2CHTR2BHTR3E |
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-9075014-B2 | pH-responsive fluorescent false neurotransmitters and their use | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2015-07-07 | — | — | US | disclosed |
| US-20130171664-A1 | PH-RESPONSIVE FLUORESCENT FALSE NEUROTRANSMITTERS AND THEIR USE | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK | 2013-07-04 | — | — | US | disclosed |