Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 3/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CRHBP | P24387 | 1/20 | 0.33 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.33 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.32 |
| ▸ | CALCRL | Q16602 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8104245 | 0.94 | RORC (0.38) | MAPTALDH1A1PSMB5POLBCNR1 | |
| SCHEMBL8118826 | 0.88 | MAPT (0.38) | MAPTALDH1A1PSMB5PANK3RAB9A | |
| SCHEMBL8113212 | 0.86 | MAPT (0.38) | MAPTALDH1A1PSMB5PANK3RAB9A | |
| Hydrochloric Acid SCHEMBL8118843 | 0.85 | NLRP3 (0.35) | NLRP3MAPTLMNAGAACRHBP | |
| SCHEMBL8112930 | 0.84 | ALDH1A1 (0.35) | MAPTALDH1A1PSMB5PANK3RAB9A | |
| SCHEMBL8104039 | 0.80 | RAB9A (0.35) | MAPTALDH1A1PSMB5PANK3RAB9A | |
| SCHEMBL8113521 | 0.77 | MAPT (0.42) | MAPTALDH1A1PSMB5POLBPANK3 | |
| Hydrochloric Acid SCHEMBL8104643 | 0.73 | ITGB3 (0.34) | MAPTRAB9ALMNASMN1; SMN2NPC1 | |
| SCHEMBL8113537 | 0.72 | ALDH1A1 (0.48) | MAPTALDH1A1POLBCNR1RAB9A | |
| Hydrochloric Acid SCHEMBL8118543 | 0.71 | F2 (0.37) | RAB9ASMN1; SMN2NPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1020434-A1 | 3-AMIDINOANILINE DERIVATIVES, ACTIVATED BLOOD COAGULATION FACTOR X INHIBITORS, AND INTERMEDIATES FOR PRODUCING BOTH | Kissei Pharmaceutical Co., Ltd. (JP) | 2000-07-19 | — | — | EP | disclosed |