Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 9/20 | 0.47 |
| ▸ | NPC1 | O15118 | 8/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | EIF4E | P06730 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 3/20 | 0.39 |
| ▸ | CTSS | P25774 | 3/20 | 0.39 |
| ▸ | CTSL | P07711 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6183464 | 0.80 | NPC1 (0.48) | RAB9ANPC1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL6185260 | 0.73 | NPC1 (0.49) | RAB9ANPC1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL7060328 | 0.72 | RAB9A (0.47) | RAB9ANPC1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL6183458 | 0.72 | CTSB (0.63) | RAB9ANPC1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL16964146 | 0.72 | KDM4E (0.54) | RAB9ANPC1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL6184482 | 0.72 | RAB9A (0.51) | RAB9ANPC1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL6185266 | 0.70 | RAB9A (0.46) | RAB9ANPC1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL6182545 | 0.70 | CTSB (0.75) | CTSBCTSSCTSL | |
| SCHEMBL6183646 | 0.70 | PARP1 (0.52) | SMN1; SMN2KDM4EMAPTALDH1A1HPGD | |
| SCHEMBL6183920 | 0.70 | NPC1 (0.45) | RAB9ANPC1SMN1; SMN2MAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6593327-B2 | N-cyanomethyl amides which are cysteine protease inhibitors; treating osteoporosis; mixtures with bisphosphonates | AXYS PHARMACEUTICALS, INC. | 2003-07-15 | — | — | US | disclosed |