Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 4/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD5 | P21918 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8331076 | 0.88 | KDM1A (0.49) | KDM1AHTR2AHTR2CHTR2BALOX5 | |
| SCHEMBL8331361 | 0.86 | HTR2A (0.45) | KDM1AHTR2AHTR2CHTR2BALOX5 | |
| SCHEMBL8331608 | 0.86 | HTR2A (0.45) | KDM1AHTR2AHTR2CHTR2BALOX5 | |
| SCHEMBL8332794 | 0.85 | SLC9A1 (0.47) | HTR2AHTR2CHTR2BALOX5 | |
| SCHEMBL8331485 | 0.85 | HTR2A (0.44) | KDM1AHTR2AHTR2CHTR2BALOX5 | |
| SCHEMBL8329354 | 0.83 | SLC9A1 (0.51) | HTR2AHTR2CHTR2BALOX5TSHR | |
| SCHEMBL8334103 | 0.81 | KDM1A (0.48) | KDM1AHTR2AHTR2CHTR2BALOX5 | |
| SCHEMBL8330436 | 0.80 | KDM1A (0.51) | KDM1AHTR2AHTR2CHTR2BALOX5 | |
| SCHEMBL8716294 | 0.76 | ALOX5 (0.34) | KDM1AHTR2AHTR2CHTR2BALOX5 | |
| SCHEMBL8716974 | 0.74 | SLC6A2 (0.36) | KDM1AALOX5SLC6A4SLC6A3 |
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 |