Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10030191 | 0.83 | TDP1 (0.55) | SMN1; SMN2ALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL21938668 | 0.82 | ALDH1A1 (0.43) | SMN1; SMN2MAPK1ALDH1A1HPGDTSHR | |
| SCHEMBL566084 | 0.80 | PDE4B (0.42) | ALDH1A1HPGDPDE4BLMNAMEN1 | |
| SCHEMBL30061341 | 0.79 | ALDH1A1 (0.44) | SMN1; SMN2ALDH1A1TSHRNPC1RAB9A | |
| SCHEMBL13664958 | 0.79 | SMN1; SMN2 (0.64) | SMN1; SMN2MAPK1ALDH1A1HPGDTSHR | |
| SCHEMBL828475 | 0.78 | AR (0.53) | SMN1; SMN2MAPK1ALDH1A1HPGDTSHR | |
| SCHEMBL19779772 | 0.78 | SSTR4 (0.44) | SMN1; SMN2ALDH1A1HPGDTSHRGAA | |
| SCHEMBL566085 | 0.78 | KDM4E (0.44) | ALDH1A1KDM4EPDE4BMEN1KMT2A | |
| SCHEMBL4841450 | 0.78 | LMNA (0.58) | SMN1; SMN2MAPK1ALDH1A1HPGDTSHR | |
| SCHEMBL4845134 | 0.77 | ALDH1A1 (0.72) | SMN1; SMN2MAPK1ALDH1A1HPGDTSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-6277851-B1 | ORALLY ADMINISTERED TRYPSIN-RELATED SERINE PROTEASE INHIBITORS; ANTICOAGULANTS | ADIR ET COMPAGNIE (FR) | 2001-08-21 | — | — | US | disclosed |