Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 3/20 | 0.43 |
| ▸ | CTSK | P43235 | 3/20 | 0.43 |
| ▸ | SGMS2 | Q8NHU3 | 2/20 | 0.43 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.42 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.42 |
| ▸ | CTSV | O60911 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7787025 | 0.83 | CAPN1 (0.52) | CAPN1NPC1MEN1TP53KMT2A | |
| SCHEMBL7380650 | 0.82 | SGMS2 (0.53) | CAPN1RAB9ASGMS2SLC1A5ALDH1A1 | |
| SCHEMBL16418410 | 0.76 | CTSD (0.58) | RAB9ARXFP1SGMS2SLC1A5NPC1 | |
| SCHEMBL7375746 | 0.76 | CAPN1 (0.54) | CAPN1RAB9ARXFP1CTSSCTSK | |
| Hydrochloric Acid SCHEMBL7787790 | 0.75 | CAPN1 (0.50) | CAPN1RAB9ACTSSCTSKNPC1 | |
| Hydrochloric Acid SCHEMBL7787786 | 0.75 | CAPN1 (0.50) | CAPN1RAB9ACTSSCTSKNPC1 | |
| SCHEMBL16418409 | 0.74 | MAPT (0.49) | RAB9ARXFP1SGMS2NPC1MEN1 | |
| SCHEMBL27676596 | 0.73 | CTSS (0.49) | CAPN1CTSSCTSKKMT2ASMN1; SMN2 | |
| SCHEMBL2447492 | 0.71 | ALDH1A1 (0.55) | RAB9ASGMS2SLC1A5NPC1TP53 | |
| SCHEMBL3757098 | 0.70 | PARP10 (0.60) | RAB9ASLC1A5NPC1MEN1KMT2A |
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 3 patents. 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 |
| EP-0944584-A1 | BENZAMIDOALDEHYDES AND THEIR USE AS CYSTEINE PROTEASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 1999-09-29 | — | — | EP | disclosed |
| WO-1998023581-A1 | BENZAMIDOALDEHYDES AND THEIR USE AS CYSTEINE PROTEASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 1998-06-04 | — | — | WO | disclosed |