Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 2/20 | 0.34 |
| ▸ | SLC6A5 | Q9Y345 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NOD1 | Q9Y239 | 4/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.33 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7443855 | 0.86 | ITGB3 (0.36) | CRHBPCRHR2ITGB3ITGA2B | |
| SCHEMBL7969566 | 0.85 | ITGB3 (0.44) | FAAHSLC6A5NOD1ITGB3ITGA2B | |
| SCHEMBL8492251 | 0.85 | FAAH (0.34) | FAAHSLC6A5MAPTSMN1; SMN2KDM4E | |
| SCHEMBL7439854 | 0.85 | FAAH (0.34) | FAAHSLC6A5MAPTSMN1; SMN2KDM4E | |
| SCHEMBL7969576 | 0.80 | MAPK1 (0.43) | SMN1; SMN2GAAHPGDITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL7445530 | 0.73 | CRHBP (0.38) | CRHBPCRHR2MAPTNPC1XBP1 | |
| SCHEMBL7986501 | 0.70 | ITGB3 (0.38) | FAAHALDH1A1NOD1ITGB3ITGA2B | |
| SCHEMBL8492244 | 0.70 | ITGB3 (0.38) | FAAHALDH1A1NOD1ITGB3ITGA2B | |
| SCHEMBL7986514 | 0.70 | ITGB3 (0.38) | FAAHSLC6A5ALDH1A1NOD1ITGB3 | |
| SCHEMBL7983190 | 0.69 | ITGB3 (0.52) | MAPTSMN1; SMN2GAAHPGDITGB3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995014008-A1 | SUBSTITUTED 5-RING HETEROCYCLES, THEIR PREPARATION AND THEIR USE | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-05-26 | — | — | WO | disclosed |