Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | F12 | P00748 | 1/20 | 0.40 |
| ▸ | F7 | P08709 | 1/20 | 0.40 |
| ▸ | F3 | P13726 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL6374349 | 0.79 | ALDH1A1 (0.41) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL730326 | 0.78 | POLB (0.48) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL3066458 | 0.76 | POLB (0.46) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL338161 | 0.74 | ALDH1A1 (0.41) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL11377643 | 0.74 | HDAC1 (0.42) | ALDH1A1MAPTPOLBF2F10 | |
| SCHEMBL11009208 | 0.74 | ALDH1A1 (0.52) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL2389975 | 0.74 | ATM (0.50) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL10722261 | 0.74 | GSK3B (0.52) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL11718171 | 0.74 | MAPT (0.44) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL3077851 | 0.74 | ALDH1A1 (0.41) | ALDH1A1MAPTPOLBKMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007001406-A2 | ARYL-CONTAINING MACROCYCLIC COMPOUNDS | CHIRON CORPORATION (US) | 2007-01-04 | — | — | WO | claimed |
| WO-2007001406-A2 | ARYL-CONTAINING MACROCYCLIC COMPOUNDS | CHIRON CORPORATION (US) | 2007-01-04 | — | — | WO | disclosed |