Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.65 |
| ▸ | HTR1A | P08908 | 6/20 | 0.63 |
| ▸ | MTNR1A | P48039 | 6/20 | 0.62 |
| ▸ | HTR1D | P28221 | 5/20 | 0.62 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.62 |
| ▸ | HTR1B | P28222 | 4/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.62 |
| ▸ | HTR2B | P41595 | 3/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.62 |
| ▸ | HTR2A | P28223 | 3/20 | 0.62 |
| ▸ | HTR2C | P28335 | 3/20 | 0.62 |
| ▸ | HTR7 | P34969 | 3/20 | 0.62 |
| ▸ | HTR6 | P50406 | 3/20 | 0.62 |
| ▸ | HTR1E | P28566 | 2/20 | 0.62 |
| ▸ | HTR5A | P47898 | 2/20 | 0.62 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.62 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.62 |
| ▸ | HTR3B | O95264 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | HTR1F | P30939 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL5085972 | 0.93 | KMT2A (0.65) | KMT2AHTR1AMTNR1AHTR1DMTNR1B | |
| SCHEMBL4075720 | 0.92 | KMT2A (0.72) | KMT2AHTR1AMTNR1AHTR1DMTNR1B | |
| SCHEMBL466333 | 0.83 | KMT2A (0.70) | KMT2AHTR1AMTNR1AHTR1DMTNR1B | |
| SCHEMBL5144423 | 0.83 | KMT2A (0.74) | KMT2AHTR1AMTNR1AHTR1DMTNR1B | |
| SCHEMBL5227242 | 0.82 | KMT2A (0.69) | KMT2AHTR1AMTNR1AHTR1DMTNR1B | |
| SCHEMBL28414663 | 0.82 | KMT2A (0.69) | KMT2AHTR1AMTNR1AHTR1DMTNR1B | |
| SCHEMBL16058705 | 0.82 | KMT2A (0.69) | KMT2AHTR1AMTNR1AHTR1DMTNR1B | |
| SCHEMBL3689658 | 0.82 | KMT2A (0.59) | KMT2AHTR1AMTNR1AHTR1DMTNR1B | |
| SCHEMBL2577657 | 0.81 | KMT2A (0.55) | KMT2AHTR1AMTNR1AHTR1DMTNR1B | |
| SCHEMBL5146979 | 0.81 | KMT2A (0.66) | KMT2AHTR1AMTNR1AHTR1DMTNR1B |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008035177-A2 | COMBINATION OF MT1 AND MT2 MELATONIN RECEPTOR AGONISTS AND A NOREPINEPHRINE/DOPAMINE REUPTAKE INHIBITOR | COPHARM (LU) | 2008-03-27 | — | — | WO | disclosed |