Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MME | P08473 | 1/20 | 0.36 |
| ▸ | ACE | P12821 | 1/20 | 0.36 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.36 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | FAAH | O00519 | 2/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL9929765 | 1.00 | CYP3A4 (0.36) | CYP3A4KDM4EKMT2AALDH1A1TSHR | |
| SCHEMBL9974772 | 1.00 | CYP3A4 (0.36) | CYP3A4KDM4EKMT2AALDH1A1TSHR | |
| SCHEMBL19573831 | 0.88 | FFAR1 (0.38) | FAAHMMP12MMP13NAAA | |
| SCHEMBL18691797 | 0.88 | GRM2 (0.42) | RIPK1 | |
| SCHEMBL14890375 | 0.88 | GRM2 (0.42) | RIPK1 | |
| SCHEMBL14919044 | 0.88 | GRM2 (0.42) | RIPK1 | |
| SCHEMBL1908573 | 0.88 | SMN1; SMN2 (0.38) | KDM4EKMT2ATSHRSMN1; SMN2MME | |
| SCHEMBL597215 | 0.88 | SMN1; SMN2 (0.38) | KDM4EKMT2ATSHRSMN1; SMN2MME | |
| SCHEMBL599395 | 0.88 | SMN1; SMN2 (0.38) | KDM4EKMT2ATSHRSMN1; SMN2MME | |
| SCHEMBL1908540 | 0.88 | SMN1; SMN2 (0.38) | KDM4EKMT2ATSHRSMN1; SMN2MME |
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-2855464-B1 | NITRIC OXIDE DONOR NEPRILYSIN INHIBITORS | THERAVANCE BIOPHARMA R&D IP LLC (US) | 2016-10-26 | — | — | EP | disclosed |