Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.53 |
| ▸ | CES1 | P23141 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.43 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.43 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3270436 | 0.81 | RAB9A (0.48) | CES2CES1KMT2ASMN1; SMN2RAB9A | |
| SCHEMBL10542828 | 0.79 | CES2 (0.53) | CES2CES1KMT2AMAOBSMN1; SMN2 | |
| SCHEMBL3038740 | 0.77 | MAOB (0.58) | CES2CES1KMT2AMAOBSMN1; SMN2 | |
| SCHEMBL3038749 | 0.77 | MAOB (0.58) | CES2CES1KMT2AMAOBSMN1; SMN2 | |
| SCHEMBL31135004 | 0.76 | CES2 (0.54) | CES2CES1KMT2ASMN1; SMN2RAB9A | |
| SCHEMBL363937 | 0.75 | — | — | |
| SCHEMBL30698159 | 0.75 | KMT2A (0.69) | CES2CES1KMT2AMAOBSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11748963 | 0.73 | KMT2A (0.67) | CES2CES1KMT2AMAOBSMN1; SMN2 | |
| SCHEMBL1233290 | 0.72 | CES2 (0.72) | CES2CES1KMT2ASMN1; SMN2RAB9A | |
| SCHEMBL17064935 | 0.71 | MAPT (0.51) | CES2CES1KMT2AMAOBSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1105706-C | Cyclic amidino formulations useful as nitric oxide synthase inhibitors | SEARLE & CO (US) | 2003-04-16 | — | — | CN | claimed |
| CN-1305993-A | Cyclic guanyl preparation used as nitrogen oxide synthetic enzyme inhibitor | SEARLE & CO (US) | 2001-08-01 | — | — | CN | claimed |
| CN-1189823-A | Cyclic amidino formulations useful as nitric oxide synthase inhibitors | SEARLE & CO (US) | 1998-08-05 | — | — | CN | claimed |