Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 3/20 | 0.69 |
| ▸ | MC1R | Q01726 | 4/20 | 0.55 |
| ▸ | MC5R | P33032 | 3/20 | 0.55 |
| ▸ | MC3R | P41968 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | HTR2C | P28335 | 2/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 2/20 | 0.47 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.47 |
| ▸ | HTR3B | O95264 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.47 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8240955 | 0.86 | SLC6A4 (0.69) | SLC6A4MC1RMC5RMC3RHTT | |
| SCHEMBL10119880 | 0.82 | SLC6A4 (0.49) | SLC6A4MC1RMC5RKMT2ABCHE | |
| SCHEMBL1998835 | 0.82 | SLC6A4 (1.00) | SLC6A4KMT2AHTR2CADRB2HTR6 | |
| SCHEMBL30592374 | 0.82 | SLC6A4 (1.00) | SLC6A4KMT2AHTR2CADRB2HTR6 | |
| SCHEMBL8271475 | 0.82 | SLC6A4 (0.67) | SLC6A4HTR6GPR84 | |
| SCHEMBL10119820 | 0.82 | SLC6A4 (0.72) | SLC6A4GPR84 | |
| SCHEMBL10119871 | 0.82 | SLC6A4 (0.72) | SLC6A4GPR84 | |
| SCHEMBL10119730 | 0.82 | SLC6A4 (0.51) | SLC6A4KMT2AHTR6MEN1 | |
| SCHEMBL10119870 | 0.80 | HTT (0.76) | SLC6A4MC1RMC5RMC3RHTT | |
| SCHEMBL7847712 | 0.79 | HPGD (0.65) | SLC6A4HTTKMT2ABCHEMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1781639-B1 | SUBSTITUTED INDOLYL ALKYL AMINO DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE | JANSSEN PHARMACEUTICA NV (BE) | 2012-01-25 | — | — | EP | disclosed |