Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | CTSB | P07858 | 2/20 | 0.46 |
| ▸ | ELANE | P08246 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 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 | |
|---|---|---|---|---|
| SCHEMBL8554945 | 0.88 | ALDH1A1 (0.56) | ALDH1A1CTSBELANETDP1MAPK1 | |
| SCHEMBL24713353 | 0.86 | ALDH1A1 (0.54) | ALDH1A1CTSBELANETDP1MAPK1 | |
| SCHEMBL19105358 | 0.79 | CTSB (0.61) | ALDH1A1CTSBELANETDP1MAPK1 | |
| SCHEMBL22572740 | 0.79 | ALDH1A1 (0.60) | ALDH1A1CTSBELANETDP1MAPK1 | |
| SCHEMBL7689071 | 0.79 | ALDH1A1 (0.60) | ALDH1A1CTSBELANETDP1MAPK1 | |
| SCHEMBL27505465 | 0.77 | CTSB (0.53) | ALDH1A1CTSBELANETDP1MAPK1 | |
| SCHEMBL5021076 | 0.76 | ALDH1A1 (0.58) | ALDH1A1CTSBELANETDP1MAPK1 | |
| SCHEMBL16994619 | 0.76 | ALDH1A1 (0.58) | ALDH1A1CTSBELANETDP1MAPK1 | |
| SCHEMBL998611 | 0.76 | CTSB (0.58) | ALDH1A1CTSBELANETDP1MAPK1 | |
| SCHEMBL2068112 | 0.76 | CTSB (0.58) | ALDH1A1CTSBELANETDP1MAPK1 |
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-0824523-A1 | NITRIC OXIDE SYNTHASE INHIBITORS DERIVED FROM CYCLIC AMIDINES | G.D. Searle & Co. (US) | 1998-02-25 | — | — | EP | disclosed |
| WO-1996035677-A1 | NITRIC OXIDE SYNTHASE INHIBITORS DERIVED FROM CYCLIC AMIDINES | G.D. SEARLE & CO. (US) | 1996-11-14 | — | — | WO | disclosed |