Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.62 |
| ▸ | NPC1 | O15118 | 5/20 | 0.62 |
| ▸ | MAPT | P10636 | 5/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.62 |
| ▸ | MEN1 | O00255 | 2/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.55 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL9268448 | 0.91 | NPC1 (0.71) | RAB9ANPC1MAPTSMN1; SMN2MEN1 | |
| SCHEMBL28152490 | 0.87 | ALOX5 (0.67) | RAB9ANPC1MAPTSMN1; SMN2MEN1 | |
| SCHEMBL9042611 | 0.86 | NPC1 (0.56) | RAB9ANPC1MAPTMRGPRX4MAOB | |
| SCHEMBL1123058 | 0.86 | MAPT (0.62) | RAB9ANPC1MAPTSMN1; SMN2MEN1 | |
| SCHEMBL6963814 | 0.85 | MAOB (0.69) | RAB9ANPC1MAPTSMN1; SMN2MRGPRX4 | |
| SCHEMBL9370131 | 0.85 | CASP3 (0.51) | NPC1MAPTMEN1KMT2APOLB | |
| SCHEMBL11350421 | 0.85 | RAB9A (0.82) | RAB9ANPC1MAPTSMN1; SMN2MEN1 | |
| SCHEMBL10236929 | 0.85 | RAB9A (0.82) | RAB9ANPC1MAPTSMN1; SMN2MEN1 | |
| SCHEMBL6520384 | 0.84 | NR4A2 (0.71) | RAB9ANPC1MAPTSMN1; SMN2POLB | |
| SCHEMBL6162284 | 0.83 | SMN1; SMN2 (0.79) | RAB9ANPC1MAPTSMN1; SMN2MEN1 |
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-6251917-B1 | Benzamidoaldehydes and their use as cysteine protease inhibitors | BASF AKTIENGESELLSCHAFT (DE) | 2001-06-26 | — | — | US | disclosed |