Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CTSL | P07711 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL5527570 | 0.90 | CTSL (0.53) | ALDH1A1LMNACTSLHPGDGAA | |
| SCHEMBL5529207 | 0.89 | ALDH1A1 (0.54) | KMT2AMEN1ALDH1A1LMNACTSL | |
| SCHEMBL5530631 | 0.88 | TDP1 (0.56) | KMT2AMEN1ALDH1A1POLBCTSL | |
| SCHEMBL5525342 | 0.84 | CTSL (0.60) | ALDH1A1LMNACTSLGAACTSB | |
| SCHEMBL5528969 | 0.83 | PKM (0.56) | KMT2AMEN1ALDH1A1LMNACTSL | |
| SCHEMBL5522184 | 0.82 | CTSL (0.56) | POLBLMNACTSLHPGDCTSB | |
| SCHEMBL5521620 | 0.82 | CTSL (0.56) | CTSLCTSBCTSSCTSKNPC1 | |
| SCHEMBL5525451 | 0.82 | CTSL (0.49) | CTSLCTSBCTSSCTSKNPC1 | |
| SCHEMBL5529016 | 0.81 | RAB9A (0.59) | KMT2AMEN1ALDH1A1POLBLMNA | |
| SCHEMBL6690368 | 0.81 | CTSS (0.58) | KMT2AMEN1ALDH1A1POLBCTSL |
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-1178958-A2 | N-CYANOMETHYL AMIDES AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2002-02-13 | — | — | EP | disclosed |
| WO-2000055125-A2 | N-CYANOMETHYL AMIDES AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2000-09-21 | — | — | WO | disclosed |