Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SELL | P14151 | 1/20 | 0.34 |
| ▸ | SELP | P16109 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL20819738 | 0.87 | RXRA (0.36) | MAPTLPAR1SELLSELPCA12 | |
| SCHEMBL20819534 | 0.86 | KDM4E (0.39) | MAPTLPAR1MEN1KMT2AL3MBTL1 | |
| SCHEMBL20819566 | 0.83 | PTGS2 (0.37) | TSHRALDH1A1RAB9ALPAR1CA12 | |
| SCHEMBL20819569 | 0.82 | CA1 (0.43) | LCKFYNSMN1; SMN2CA12CA1 | |
| SCHEMBL20819614 | 0.81 | MEN1 (0.36) | TSHRSMN1; SMN2ALDH1A1MAPTNPC1 | |
| SCHEMBL20819559 | 0.78 | SELP (0.34) | LPAR1SELLSELPMEN1KMT2A | |
| SCHEMBL20789974 | 0.78 | ACHE (0.44) | TSHRALDH1A1MAPTLPAR1MEN1 | |
| SCHEMBL4711456 | 0.78 | LPAR1 (0.46) | SMN1; SMN2ALDH1A1MAPTLPAR1MEN1 | |
| SCHEMBL20819564 | 0.77 | RXRA (0.34) | LPAR1MEN1KMT2AL3MBTL1LMNA | |
| SCHEMBL20819542 | 0.77 | L3MBTL1 (0.33) | MAPTLPAR1SELLSELPMEN1 |
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 |