Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL9448877 | 0.85 | GPR52 (0.45) | ALDH1A1KMT2AMEN1HIF1AHTT | |
| SCHEMBL29883889 | 0.85 | GPR52 (0.45) | ALDH1A1KMT2AMEN1HIF1AHTT | |
| SCHEMBL17111283 | 0.79 | ALDH1A1 (0.46) | ALDH1A1KMT2AMEN1HIF1AHTT | |
| SCHEMBL11527927 | 0.79 | ESR1 (0.47) | ALDH1A1KMT2AMEN1HIF1AHTT | |
| SCHEMBL11527931 | 0.79 | ESR1 (0.47) | ALDH1A1KMT2AMEN1HIF1AHTT | |
| SCHEMBL11677900 | 0.77 | ESR1 (0.46) | ALDH1A1KMT2AMEN1HIF1AHTT | |
| SCHEMBL28212395 | 0.76 | ESR1 (0.45) | ALDH1A1KMT2AMEN1HIF1AHTT | |
| SCHEMBL11777211 | 0.76 | NR4A1 (0.45) | ALDH1A1KMT2AMEN1HIF1AHTT | |
| SCHEMBL27876076 | 0.74 | ESR1 (0.44) | ALDH1A1KMT2AMEN1HIF1AHTT | |
| SCHEMBL6642077 | 0.72 | P2RX7 (0.50) | ALDH1A1KMT2AMEN1HIF1AHTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0722448-A4 | O-ARYL, O-ALKYL, O-ALKENYL AND O-ALKYNYL-MACROLIDES HAVING IMMUNOSUPPRESSIVE ACTIVITY | MERCK & CO INC (US) | 1998-04-29 | — | — | EP | disclosed |
| CN-1137275-A | O-aryl O-alkyl O-alkenyl and O-alkynyl-macrolides having immunosuppressive activity | MERCK & CO INC (US) | 1996-12-04 | — | — | CN | disclosed |
| EP-0722448-A1 | O-ARYL, O-ALKYL, O-ALKENYL AND O-ALKYNYL-MACROLIDES HAVING IMMUNOSUPPRESSIVE ACTIVITY | MERCK & CO. INC. (US) | 1996-07-24 | — | — | EP | disclosed |