Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 2/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.37 |
| ▸ | ESRRG | P62508 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 2/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6980588 | 0.86 | NPC1 (0.48) | NPC1RAB9ASMN1; SMN2EPHX2KCNA5 | |
| SCHEMBL6980590 | 0.86 | NPC1 (0.48) | NPC1RAB9ASMN1; SMN2EPHX2KCNA5 | |
| SCHEMBL6986672 | 0.82 | MMP1 (0.44) | CTSKCTSSMMP1MMP3MMP9 | |
| SCHEMBL7955112 | 0.78 | MAPT (0.40) | NPC1RAB9ASMN1; SMN2CTSKKDM4E | |
| SCHEMBL7836648 | 0.78 | MAPT (0.40) | NPC1RAB9ASMN1; SMN2CTSKKDM4E | |
| SCHEMBL7955175 | 0.77 | KMT2A (0.43) | NPC1RAB9ASMN1; SMN2CTSKKDM4E | |
| SCHEMBL6981775 | 0.77 | KMT2A (0.43) | NPC1RAB9ASMN1; SMN2CTSKKDM4E | |
| SCHEMBL27508603 | 0.77 | KMT2A (0.43) | NPC1RAB9ASMN1; SMN2CTSKKDM4E | |
| SCHEMBL7957323 | 0.77 | CTSK (0.53) | CTSKCTSLCTSBCTSS | |
| SCHEMBL6942460 | 0.77 | ADAM17 (0.46) | CTSKADAM17MMP1MMP2MMP3 |
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-1089964-B1 | HYDRAZINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2003-10-29 | — | — | EP | disclosed |
| US-6239151-B1 | TREATMENT OF INFLAMMATORY AND AUTOIMMUNE DISEASES, OSTEOARTHRITIS, RESPIRATORY DISEASES, TUMORS, CACHEXIA, CARDIOVASCULAR DISEASES, FEVER, HAEMORRHAGE AND SEPSIS, HYDRAZINE DERIVATIVES, | HOFFMANN-LA ROCHE INC. | 2001-05-29 | — | — | US | disclosed |