Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDB1 | Q16531 | 1/20 | 0.42 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 4/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | HTR2B | P41595 | 2/20 | 0.34 |
| ▸ | MPO | P05164 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20002189 | 1.00 | DDB1 (0.42) | DDB1CRBNHTR2CHTR6MAOA | |
| SCHEMBL2547361 | 0.89 | DDB1 (0.45) | DDB1CRBNMAOAMAOBHTR3A | |
| Hydrochloric Acid SCHEMBL2773983 | 0.87 | DDB1 (0.44) | DDB1CRBNMAOAMAOBHTR3A | |
| Hydrochloric Acid SCHEMBL10799877 | 0.85 | MAOA (0.43) | DDB1CRBNMAOAMAOBHTR3A | |
| SCHEMBL16434776 | 0.84 | CRBN (0.43) | DDB1CRBNHTR2CHTR6MAOA | |
| Hydrochloric Acid SCHEMBL16423208 | 0.82 | CRBN (0.42) | DDB1CRBNHTR2CHTR6HTR3A | |
| SCHEMBL10795325 | 0.81 | HTR3A (0.55) | DDB1CRBNHTR2CHTR3ASLC6A2 | |
| SCHEMBL10798755 | 0.81 | CRBN (0.42) | DDB1CRBNHTR2CHTR6MAOA | |
| SCHEMBL7899199 | 0.81 | SLC18A3 (0.41) | DDB1CRBNMAOAMAOBHTR3A | |
| Bromide SCHEMBL6874908 | 0.80 | NR1H2 (0.35) | MAOAMAOBHTR3ASLC6A2SLC6A4 |
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-3092229-B1 | PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS | BRISTOL MYERS SQUIBB CO (US) | 2018-03-28 | — | — | EP | disclosed |