Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 4/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.37 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.36 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.35 |
| ▸ | CHRNG | P07510 | 1/20 | 0.35 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8331072 | 0.84 | HTR2C (0.47) | KDM1ASLC6A3SLC6A4HTR2AHTR2C | |
| SCHEMBL8331076 | 0.83 | KDM1A (0.49) | KDM1ASLC6A3SLC6A4HTR2AHTR2C | |
| SCHEMBL8333598 | 0.83 | SLC9A1 (0.52) | KDM1ASLC6A3HTR2AHTR2CHTR2B | |
| SCHEMBL8332790 | 0.81 | SLC9A1 (0.56) | HTR2AHTR2CHTR2BALOX5TSHR | |
| SCHEMBL8332822 | 0.80 | KDM1A (0.46) | KDM1ASLC6A3SLC6A4HTR2AHTR2C | |
| SCHEMBL27430078 | 0.79 | SLC9A1 (0.56) | ALOX5TSHRSLC9A1 | |
| SCHEMBL4134867 | 0.74 | KDM1A (0.59) | KDM1ASLC6A3SLC6A4HTR2AHTR2C | |
| SCHEMBL4134864 | 0.74 | KDM1A (0.59) | KDM1ASLC6A3SLC6A4HTR2AHTR2C | |
| SCHEMBL27350337 | 0.74 | KDM1A (0.50) | KDM1ASLC6A3SLC6A4HTR2AHTR2C | |
| SCHEMBL25606213 | 0.71 | KDM1A (0.54) | KDM1ASLC6A3SLC6A4HTR2AHTR2C |
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-5889031-A | CONTROLLING CIRCADIAN RHYTHMS | BRISTOL-MYERS SQUIBB COMPNAY (US) | 1999-03-30 | — | — | US | disclosed |
| US-5753709-A | N-acyl-2 aryl cyclopropylmethylamine derivatives as melatonergics | BRISTOL-MYERS SQUIBB COMPANY (US) | 1998-05-19 | — | — | US | disclosed |