Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.50 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | F2 | P00734 | 1/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.46 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.46 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | IL1RN | P18510 | 1/20 | 0.45 |
| ▸ | KMO | O15229 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14185292 | 0.87 | ALDH1A1 (0.51) | ALDH1A1LMNAMEN1KMT2AHSD11B1 | |
| SCHEMBL8974969 | 0.85 | AKR1C3 (0.53) | ALDH1A1LMNAAKR1C3MEN1KMT2A | |
| SCHEMBL6417389 | 0.84 | LMNA (0.62) | ALDH1A1LMNAMEN1KMT2AHSD11B1 | |
| SCHEMBL14185293 | 0.83 | ALDH1A1 (0.50) | ALDH1A1LMNAMEN1KMT2AHSD11B1 | |
| SCHEMBL2189346 | 0.79 | LMNA (0.85) | ALDH1A1LMNAMEN1KMT2AHSD11B1 | |
| SCHEMBL11576079 | 0.78 | APOBEC3G (0.56) | ALDH1A1LMNAKMT2ASMN1; SMN2CA1 | |
| SCHEMBL7407285 | 0.78 | LMNA (0.62) | ALDH1A1LMNAAKR1C3AKR1C1MEN1 | |
| SCHEMBL18392278 | 0.77 | MCL1 (0.68) | ALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL30076562 | 0.77 | MCL1 (0.68) | ALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL21647723 | 0.76 | SMN1; SMN2 (0.46) | ALDH1A1MEN1KMT2ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996039132-A1 | N,N-DISULFONYLATED AMINOBENZENE CARBOXYLIC ACIDS AND THE USE THEREOF AS THROMBIN INHIBITORS | 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) | 1996-12-12 | — | — | WO | disclosed |
| US-5559150-A | ANTICOAGULANT, ANTITUMOR, ANTIINFLAMMATORY | 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) | 1996-09-24 | — | — | US | disclosed |