Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYCS | P99999 | 4/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ICMT | O60725 | 1/20 | 0.33 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.32 |
| ▸ | TOP1 | P11387 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | DHODH | Q02127 | 2/20 | 0.32 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.31 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.31 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8865785 | 0.98 | MAPT (0.37) | MAPTCYCSPDE3BPDE3AP2RY12 | |
| SCHEMBL8865497 | 0.91 | MAPT (0.41) | MAPTCYCSPDE3BPDE3AP2RY12 | |
| SCHEMBL8865532 | 0.86 | PDE3B (0.34) | PDE3BPDE3AP2RY12ALDH1A1HPGD | |
| SCHEMBL8865213 | 0.79 | ABCG2 (0.39) | CYCSHPGDABCG2TOP1NPC1 | |
| SCHEMBL8909582 | 0.79 | TOP1 (0.44) | CYCSABCG2TOP1DHODHFABP4 | |
| Hydrochloric Acid SCHEMBL8865595 | 0.78 | TOP1 (0.43) | CYCSABCG2TOP1DHODHFABP4 | |
| SCHEMBL8865560 | 0.78 | DAGLA (0.36) | MAPTALDH1A1 | |
| SCHEMBL8908515 | 0.77 | TOP1 (0.44) | CYCSABCG2TOP1DHODHFABP4 | |
| Hydrochloric Acid SCHEMBL8865553 | 0.76 | TOP1 (0.43) | CYCSABCG2TOP1DHODHFABP4 | |
| SCHEMBL8865339 | 0.76 | SYK (0.40) | MAPTCYCSPDE3BPDE3AP2RY12 |
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-5674467-A | USED IN NMR DIAGNOSIS, RADIODIAGNOSIS OR RADIOTHERAPY | INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH (DE) | 1997-10-07 | — | — | US | disclosed |