Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 9/20 | 0.70 |
| ▸ | NPC1 | O15118 | 7/20 | 0.70 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.70 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.70 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.70 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.70 |
| ▸ | POLB | P06746 | 1/20 | 0.70 |
| ▸ | MEN1 | O00255 | 4/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.67 |
| ▸ | DRD4 | P21917 | 1/20 | 0.60 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.60 |
| ▸ | USP2 | O75604 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | SORD | Q00796 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7534676 | 0.83 | RAB9A (0.67) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL15941384 | 0.83 | RAB9A (0.67) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL3157852 | 0.82 | RAB9A (1.00) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL23965748 | 0.82 | RAB9A (0.69) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL6125228 | 0.80 | RAB9A (0.70) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL7760900 | 0.80 | RAB9A (1.00) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL28142588 | 0.79 | RAB9A (0.72) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL27652569 | 0.79 | RAB9A (0.72) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL15086770 | 0.79 | RAB9A (0.68) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL8526236 | 0.78 | RAB9A (0.73) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2D6 |
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-0802196-B1 | Alkylenediamine derivatives as drugs for the treatment of ulcers and the inhibition of Helicobacter pylori | SHISEIDO CO LTD (JP) | 2001-08-29 | — | — | EP | disclosed |
| EP-0802196-A1 | Alkylenediamine derivative, antiulcer drug, and antibacterial drug | SHISEIDO COMPANY LIMITED (JP) | 1997-10-22 | — | — | EP | disclosed |