Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | PDE2A | O00408 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.39 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14731436 | 1.00 | ALDH1A1 (0.52) | ALDH1A1MEN1KMT2APDE2ATSHR | |
| SCHEMBL9203028 | 0.79 | MEN1 (0.52) | ALDH1A1MEN1KMT2APDE2ALMNA | |
| SCHEMBL14930399 | 0.78 | SMN1; SMN2 (0.51) | ALDH1A1MEN1KMT2APDE2ALMNA | |
| SCHEMBL22875115 | 0.74 | PDK1 (0.48) | ALDH1A1MEN1KMT2ATSHRLMNA | |
| SCHEMBL10206058 | 0.74 | KMT2A (0.52) | MEN1KMT2APDE2ATSHRRECQL | |
| SCHEMBL15718708 | 0.74 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2APDE2ATSHR | |
| SCHEMBL13149845 | 0.71 | ALDH1A1 (0.52) | ALDH1A1MEN1KMT2ATSHRHPGD | |
| SCHEMBL1806989 | 0.71 | FPR2 (0.49) | ALDH1A1MEN1KMT2A | |
| SCHEMBL21712549 | 0.71 | ATM (0.56) | ALDH1A1MEN1KMT2ARECQLLMNA | |
| SCHEMBL286931 | 0.70 | KDM4E (0.58) | ALDH1A1MEN1KMT2ATSHRLMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013026163-A1 | HEPATITIS C INHIBITOR COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2013-02-28 | — | — | WO | disclosed |