Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.50 |
| ▸ | NOS1 | P29475 | 1/20 | 0.50 |
| ▸ | NOS2 | P35228 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.49 |
| ▸ | RAB9A | P51151 | 11/20 | 0.48 |
| ▸ | NPC1 | O15118 | 8/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.47 |
| ▸ | RELA | Q04206 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.44 |
| ▸ | CYP2C8 | P10632 | 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 | |
|---|---|---|---|---|
| SCHEMBL8307517 | 0.87 | RAB9A (0.55) | NOS3NOS1NOS2SMN1; SMN2RAB9A | |
| SCHEMBL9276001 | 0.85 | RAB9A (0.62) | NOS3NOS1NOS2SMN1; SMN2RAB9A | |
| SCHEMBL8305285 | 0.83 | NOS3 (0.51) | NOS3NOS1NOS2SMN1; SMN2RAB9A | |
| SCHEMBL9274369 | 0.83 | NOS3 (0.54) | NOS3NOS1NOS2SMN1; SMN2RAB9A | |
| SCHEMBL7814469 | 0.81 | NOS3 (0.53) | NOS3NOS1NOS2SMN1; SMN2RAB9A | |
| SCHEMBL9275118 | 0.81 | RAB9A (0.60) | NOS3NOS1NOS2SMN1; SMN2RAB9A | |
| SCHEMBL9276310 | 0.81 | MEN1 (0.58) | NOS3NOS1NOS2SMN1; SMN2RAB9A | |
| SCHEMBL12195201 | 0.81 | RAB9A (0.61) | SMN1; SMN2RAB9ANPC1CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL7818020 | 0.80 | NOS3 (0.52) | NOS3NOS1NOS2SMN1; SMN2RAB9A | |
| SCHEMBL9273096 | 0.80 | RAB9A (0.56) | NOS3NOS1NOS2SMN1; SMN2RAB9A |
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-0683776-B1 | SUBSTITUTED HETEROARYLALKYLTHIOPYRIDINES FOR CONTROLLING HELICOBACTER BACTERIA | BYK GULDEN LOMBERG CHEM FAB (DE) | 1999-04-07 | — | — | EP | disclosed |
| US-5587389-A | Substituted heteroarylaklylthiopyridines for controlling helicobacter bacteria | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1996-12-24 | — | — | US | disclosed |