Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.33 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL20819549 | 0.88 | HPGD (0.40) | CYP3A4MEN1KMT2ANPSR1HPGD | |
| SCHEMBL20819606 | 0.86 | LCK (0.35) | CYP3A4MEN1KMT2ANPSR1HPGD | |
| SCHEMBL20819563 | 0.83 | HSD17B10 (0.32) | MEN1KMT2ANPSR1HPGDMAPT | |
| SCHEMBL20819588 | 0.81 | ALDH1A1 (0.45) | MEN1KMT2ANPSR1LMNAL3MBTL1 | |
| SCHEMBL20819553 | 0.81 | ALDH1A1 (0.41) | MEN1KMT2AMAPTLMNAL3MBTL1 | |
| SCHEMBL20790295 | 0.81 | LMNA (0.40) | MEN1KMT2AHPGDPOLBMAPT | |
| SCHEMBL31045607 | 0.79 | MAP3K14 (0.41) | MEN1KMT2AHPGDPOLBMAPT | |
| SCHEMBL20819738 | 0.77 | RXRA (0.36) | MEN1KMT2ANPSR1MAPTGPR35 | |
| SCHEMBL20819590 | 0.76 | ALDH1A1 (0.41) | KMT2APOLBMAPTCA12CA1 | |
| SCHEMBL20819534 | 0.75 | KDM4E (0.39) | MEN1KMT2ANPSR1MAPTGPR35 |
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-3681864-A1 | MODULATORS OF THE CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR PROTEIN AND METHODS OF USE | AbbVie Overseas S.à r.l. (LU) | 2020-07-22 | — | — | EP | disclosed |
| WO-2019053634-A1 | MODULATORS OF THE CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR PROTEIN AND METHODS OF USE | AbbVie S.à.r.l. (LU) | 2019-03-21 | — | — | WO | disclosed |