Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | NPY1R | P25929 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL31690650 | 0.88 | SMN1; SMN2 (0.58) | KMT2ANPY1RTSHRHTTATM | |
| SCHEMBL8196255 | 0.82 | ALDH1A1 (0.48) | KMT2ATSHRHTTATMSMN1; SMN2 | |
| SCHEMBL8196260 | 0.80 | CAPN1 (0.53) | KMT2ANPY1RHTTATMSMN1; SMN2 | |
| SCHEMBL14123209 | 0.80 | CAPN1 (0.53) | KMT2ANPY1RHTTATMSMN1; SMN2 | |
| SCHEMBL8204200 | 0.80 | CAPN1 (0.53) | KMT2ANPY1RHTTATMSMN1; SMN2 | |
| SCHEMBL14123190 | 0.79 | KMT2A (0.48) | KMT2ANPY1RHTTATMSMN1; SMN2 | |
| SCHEMBL14123220 | 0.79 | CTSL (0.47) | KMT2ANPY1RTSHRHTTATM | |
| SCHEMBL14123310 | 0.79 | KMT2A (0.48) | KMT2ANPY1RHTTATMSMN1; SMN2 | |
| SCHEMBL14123311 | 0.79 | CTSL (0.47) | KMT2ANPY1RTSHRHTTATM | |
| SCHEMBL14123214 | 0.79 | KMT2A (0.48) | KMT2ANPY1RHTTATMSMN1; SMN2 |
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-2008042480-A2 | EPOXIDE INHIBITORS OF CYSTEINE PROTEASES | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2008-04-10 | — | — | WO | disclosed |