Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SELE | P16581 | 1/20 | 0.48 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 12/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 9/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6220931 | 0.87 | ADORA2A (0.36) | MEN1KMT2AKDM4EHRH4ALDH1A1 | |
| SCHEMBL7213537 | 0.84 | SELE (0.44) | SELEVCAM1MEN1KMT2AKDM4E | |
| SCHEMBL27502979 | 0.81 | SELE (0.46) | SELEVCAM1MEN1KMT2AKDM4E | |
| SCHEMBL7215808 | 0.81 | F10 (0.47) | ADORA2AADORA1F10 | |
| Hydrochloric Acid SCHEMBL7219453 | 0.80 | F10 (0.47) | ADORA2AADORA1F10 | |
| Hydrochloric Acid SCHEMBL7219449 | 0.80 | F10 (0.47) | ADORA2AADORA1F10 | |
| Trifluoroacetic Acid SCHEMBL7213497 | 0.79 | P2RY12 (0.36) | MEN1KMT2AADORA2AADORA1 | |
| SCHEMBL27504720 | 0.77 | SELE (0.39) | SELEVCAM1MEN1KMT2AHDAC3 | |
| SCHEMBL7213522 | 0.75 | SELE (0.40) | SELEVCAM1MEN1KMT2AHDAC3 | |
| SCHEMBL7448973 | 0.75 | SELE (0.40) | SELEVCAM1MEN1KMT2AHDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6602864-B1 | Sulfonic acid or sulfonylamino N-(heteroaralkyl)-azaheterocyclylamide compounds | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2003-08-05 | — | — | US | disclosed |
| EP-0944386-B1 | SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS | AVENTIS PHARMA INC (US) | 2002-09-18 | — | — | EP | disclosed |
| US-6281227-B1 | INHIBITORS OF THE ACTIVITY OF FACTOR XA. | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2001-08-28 | — | — | US | disclosed |