Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | BMP1 | P13497 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | ATR | Q13535 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | REN | P00797 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 2/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
| ▸ | DHPS | P49366 | 1/20 | 0.33 |
| ▸ | FPR2 | P25090 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6802384 | 0.86 | BMP1 (0.38) | IKBKBRAB9ABMP1ATMATR | |
| SCHEMBL6806971 | 0.84 | AAK1 (0.43) | IKBKBRAB9ABMP1ATMATR | |
| SCHEMBL6806965 | 0.83 | RAB9A (0.38) | IKBKBRAB9ABMP1ATMATR | |
| SCHEMBL7357734 | 0.83 | RAB9A (0.39) | IKBKBRAB9ABMP1ATMATR | |
| SCHEMBL7361087 | 0.80 | RAB9A (0.34) | IKBKBRAB9ABMP1ATMATR | |
| SCHEMBL6798242 | 0.78 | RAB9A (0.39) | RAB9ABMP1ATMATRKCNH2 | |
| SCHEMBL6798235 | 0.77 | RAB9A (0.36) | IKBKBRAB9ABMP1ATMATR | |
| SCHEMBL6800330 | 0.70 | AAK1 (0.45) | IKBKBRAB9AALDH1A1 | |
| SCHEMBL6802381 | 0.69 | CNR1 (0.37) | LMNA | |
| SCHEMBL6800014 | 0.68 | SMN1; SMN2 (0.38) | RAB9ABMP1ALDH1A1 |
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-1159273-A1 | COMPOUNDS USEFUL AS REVERSIBLE INHIBITORS OF CATHEPSIN S | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 2001-12-05 | — | — | EP | disclosed |
| WO-2000051998-A1 | COMPOUNDS USEFUL AS REVERSIBLE INHIBITORS OF CATHEPSIN S | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2000-09-08 | — | — | WO | disclosed |