Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 1/20 | 0.47 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 7/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 3/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 3/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 3/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4583536 | 0.86 | HTR3A (0.44) | TOP2ASMN1; SMN2HTR3AMEN1KMT2A | |
| SCHEMBL6045554 | 0.83 | ERN1 (0.49) | TOP2ARAB9ASMN1; SMN2NPC1ALDH1A1 | |
| SCHEMBL2109256 | 0.77 | ERN1 (0.53) | TOP2ARAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL1618212 | 0.76 | TOP2A (0.58) | TOP2ARCE1RAB9ASMN1; SMN2HIF1A | |
| SCHEMBL11561655 | 0.76 | NPC1 (0.45) | TOP2ARAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL121325 | 0.75 | TOP2A (0.65) | TOP2ARCE1RAB9ASMN1; SMN2HIF1A | |
| SCHEMBL6297297 | 0.75 | ELANE (0.45) | MEN1KMT2AALDH1A1MAPTL3MBTL1 | |
| SCHEMBL7109574 | 0.75 | RAB9A (0.53) | TOP2ARCE1RAB9ASMN1; SMN2HIF1A | |
| SCHEMBL22085386 | 0.75 | SMN1; SMN2 (0.56) | TOP2ARCE1RAB9ASMN1; SMN2HIF1A | |
| SCHEMBL56593 | 0.75 | TOP2A (0.53) | TOP2ARCE1RAB9ASMN1; SMN2HIF1A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5412099-A | Intermediate benzothiazolyl- and benzoxazolyl-aldehyde compounds | BAYER AKTIENGESELLSCHAFT (DE) | 1995-05-02 | — | — | US | disclosed |
| EP-0450420-B1 | Dihydropyridines substituted by heterocycles, process for their preparation and their use in medicaments | BAYER AG (DE) | 1994-09-21 | — | — | EP | disclosed |
| US-5254692-A | Inotropic | BAYER AKTIENGESELLSCHAFT (DE) | 1993-10-19 | — | — | US | disclosed |
| US-5200420-A | Inotropic agents for cardiovascular disorders | BAYER AKTIENGESELLSCHAFT (DE) | 1993-04-06 | — | — | US | disclosed |
| EP-0450420-A2 | Dihydropyridines substituted by heterocycles, process for their preparation and their use in medicaments | BAYER AG (DE) | 1991-10-09 | — | — | EP | disclosed |