Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.35 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9254441 | 0.94 | TSHR (0.35) | KDM4EALDH1A1HPGDADORA3ADORA2A | |
| SCHEMBL9254562 | 0.92 | PARP1 (0.34) | KDM4EALDH1A1HPGDADORA3ADORA2A | |
| SCHEMBL9254565 | 0.86 | PARP1 (0.34) | KDM4EALDH1A1HPGDADORA3ADORA2A | |
| SCHEMBL9255731 | 0.82 | ALDH1A1 (0.38) | KDM4EALDH1A1HPGDTSHRRAB9A | |
| SCHEMBL9255106 | 0.80 | ALDH1A1 (0.36) | KDM4EALDH1A1HPGDADORA2ATSHR | |
| SCHEMBL9253893 | 0.78 | F10 (0.40) | TSHRRAB9A | |
| SCHEMBL9247338 | 0.78 | MAPT (0.38) | KDM4EALDH1A1HPGDTSHRRAB9A | |
| SCHEMBL9256887 | 0.76 | ALDH1A1 (0.37) | KDM4EALDH1A1HPGDTSHRRAB9A | |
| SCHEMBL9253869 | 0.75 | F2 (0.40) | KDM4EALDH1A1HPGDADORA2AADORA1 | |
| SCHEMBL9253103 | 0.74 | ALOX5 (0.38) | KDM4EALDH1A1HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5463071-A | Tetrazole derivatives; useful for inhibiting undesirable cell aggregation | DR. KARL THOMAE GMBH (DE) | 1995-10-31 | — | — | US | disclosed |
| EP-0525629-A2 | 5-membered heterocycles, process for their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1993-02-03 | — | — | EP | disclosed |