Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 7/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.42 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.42 |
| ▸ | CCR5 | P51681 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8054566 | 0.90 | HTR2C (0.50) | HTR2CALDH1A1POLBKDM4EHPGD | |
| SCHEMBL8054636 | 0.85 | MCHR1 (0.45) | LMNATLR9TLR8TLR7CCR5 | |
| SCHEMBL12209651 | 0.85 | HTR2C (0.45) | HTR2CALDH1A1POLBKDM4EHPGD | |
| SCHEMBL30804745 | 0.79 | KMT2A (0.59) | HTR2CMAPTALDH1A1LMNAPOLB | |
| SCHEMBL16488097 | 0.78 | QDPR (0.46) | ALDH1A1LMNAPOLBL3MBTL1KMO | |
| SCHEMBL3329900 | 0.77 | CCR5 (0.55) | HTR2CPOLBADORA2AADORA1CCR5 | |
| SCHEMBL30804735 | 0.76 | MCHR1 (0.53) | MAPTALDH1A1POLBL3MBTL1 | |
| SCHEMBL30804752 | 0.76 | MCHR1 (0.53) | MAPTALDH1A1POLBL3MBTL1 | |
| SCHEMBL13609464 | 0.75 | HCRTR1 (0.56) | HTR2CALDH1A1LMNAHPGD | |
| SCHEMBL373768 | 0.74 | LIMK2 (0.47) | HTR2CALDH1A1POLBL3MBTL1SMN1; SMN2 |
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-2380891-A1 | Substituted piperidino-dihydrothienopyrimidines | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-10-26 | — | — | EP | disclosed |