Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.35 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | PTAFR | P25105 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL1158808 | 0.84 | BCAT2 (0.46) | BCAT2HDAC1MTNR1AMTNR1BGPR84 | |
| SCHEMBL31105304 | 0.82 | SRD5A1 (0.41) | BCAT2HDAC1MTNR1AMTNR1BTSHR | |
| SCHEMBL2517925 | 0.81 | MTNR1A (0.41) | HDAC1MTNR1AMTNR1BMAPTMEN1 | |
| SCHEMBL1159546 | 0.77 | AKT1 (0.35) | BCAT2HDAC1MTNR1AMTNR1BGPR84 | |
| SCHEMBL2736494 | 0.71 | CES1 (0.41) | BCAT2GPR84TSHRMAPTSMN1; SMN2 | |
| SCHEMBL215395 | 0.70 | SERPINE1 (0.39) | BCAT2GPR84TSHRSRD5A1SRD5A2 | |
| SCHEMBL2778467 | 0.69 | HRH1 (0.43) | BCAT2HDAC1GPR84MAPTSMN1; SMN2 | |
| SCHEMBL3395760 | 0.68 | KDM4E (0.39) | HDAC1MTNR1AMTNR1BGPR84MAPT | |
| SCHEMBL5658471 | 0.67 | CES1 (0.44) | BCAT2GPR84MAPTSMN1; SMN2KDM4E | |
| SCHEMBL3397210 | 0.67 | HDAC1 (0.48) | HDAC1MTNR1AMTNR1BTSHRKDM4E |
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-2252611-B1 | (DIHYDRO)PYRROLO[2,1-A]ISOQUINOLINES | ORGANON NV (NL) | 2011-10-05 | — | — | EP | disclosed |