Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 7/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8068014 | 0.84 | JUN (0.51) | CYP17A1CYP19A1ALDH1A1KMT2AMEN1 | |
| SCHEMBL6092331 | 0.84 | JUN (0.51) | CYP17A1CYP19A1ALDH1A1KMT2AMEN1 | |
| SCHEMBL27837991 | 0.74 | KMT2A (0.62) | CYP17A1CYP19A1ALDH1A1KMT2AMEN1 | |
| SCHEMBL1769996 | 0.70 | MAPT (0.56) | CYP17A1CYP19A1KMT2AMEN1HSD11B1 | |
| SCHEMBL8077622 | 0.70 | MAPT (0.56) | CYP17A1CYP19A1KMT2AMEN1HSD11B1 | |
| SCHEMBL1770376 | 0.67 | HSD11B1 (0.54) | CYP17A1CYP19A1ALDH1A1KMT2AMEN1 | |
| SCHEMBL1548224 | 0.67 | CYP17A1 (1.00) | CYP17A1CYP19A1ALDH1A1KMT2AMEN1 | |
| SCHEMBL8075850 | 0.67 | CYP19A1 (1.00) | CYP17A1CYP19A1ALDH1A1KMT2AMEN1 | |
| SCHEMBL12040547 | 0.67 | GABBR2 (0.53) | ALDH1A1KMT2AMEN1KDM4ELMNA | |
| SCHEMBL6091145 | 0.67 | GABBR2 (0.53) | ALDH1A1KMT2AMEN1KDM4ELMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017205786-A1 | CELL PERMEABLE PEPTIDOMIMETIC MACROCYCLES | AILERON THERAPEUTICS, INC. (US) | 2017-11-30 | — | — | WO | disclosed |
| WO-2017004548-A1 | PEPTIDOMIMETIC MACROCYCLES | AILERON THERAPEUTICS, INC. (US) | 2017-01-05 | — | — | WO | disclosed |
| EP-2603600-A2 | PEPTIDOMIMETIC MACROCYCLES | Aileron Therapeutics, Inc. (US) | 2013-06-19 | — | — | EP | disclosed |
| WO-2012021876-A2 | PEPTIDOMIMETIC MACROCYCLES | AILERON THERAPEUTICS, INC. (US) | 2012-02-16 | — | — | WO | disclosed |