Known targets — ChEMBL curated mechanism
CACNA1CCACNA1DCACNA1FCACNA1SDPP4HTR1BHTR1D
The experimentally established mechanism targets of Ascomycin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FKBP1A | P62942 | 18/20 | 0.89 |
| ▸ | FKBP4 | Q02790 | 2/20 | 0.89 |
| ▸ | MEN1 | O00255 | 1/20 | 0.89 |
| ▸ | LMNA | P02545 | 1/20 | 0.89 |
| ▸ | MAPT | P10636 | 1/20 | 0.89 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.89 |
| ▸ | THRB | P10828 | 1/20 | 0.89 |
| ▸ | PPP3CA | Q08209 | 3/20 | 0.81 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.81 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.81 |
| ▸ | MLNR | O43193 | 1/20 | 0.79 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.79 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.79 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.79 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.79 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.79 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.79 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.79 |
| ▸ | HTR2A | P28223 | 1/20 | 0.79 |
| ▸ | HTR2B | P41595 | 1/20 | 0.79 |
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 | |
|---|---|---|---|---|
| Ascomycin SCHEMBL386168 | 0.94 | FKBP1A (1.00) | FKBP1AFKBP4MEN1LMNAMAPT | |
| Ascomycin SCHEMBL439467 | 0.94 | FKBP1A (1.00) | FKBP1AFKBP4MEN1LMNAMAPT | |
| Ascomycin SCHEMBL17721321 | 0.94 | FKBP1A (1.00) | FKBP1AFKBP4MEN1LMNAMAPT | |
| Ascomycin SCHEMBL25512 | 0.94 | FKBP1A (1.00) | FKBP1AFKBP4MEN1LMNAMAPT | |
| Ascomycin SCHEMBL10262882 | 0.94 | FKBP1A (1.00) | FKBP1AFKBP4MEN1LMNAMAPT | |
| Ascomycin SCHEMBL13492308 | 0.94 | FKBP1A (1.00) | FKBP1AFKBP4MEN1LMNAMAPT | |
| Ascomycin SCHEMBL2390057 | 0.94 | FKBP1A (1.00) | FKBP1AFKBP4MEN1LMNAMAPT | |
| Ascomycin SCHEMBL14113233 | 0.94 | FKBP1A (1.00) | FKBP1AFKBP4MEN1LMNAMAPT | |
| Ascomycin SCHEMBL22409504 | 0.94 | FKBP1A (1.00) | FKBP1AFKBP4MEN1LMNAMAPT | |
| Ascomycin SCHEMBL386169 | 0.94 | FKBP1A (1.00) | FKBP1AFKBP4MEN1LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0642516-A1 | MACROCYCLIC IMMUNOMODULATORS | ABBOTT LABORATORIES (US) | 1995-03-15 | — | — | EP | disclosed |
| EP-0642516-A4 | MACROCYCLIC IMMUNOMODULATORS. | ABBOTT LAB (US) | 1994-06-15 | — | — | EP | disclosed |