Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 4/20 | 0.37 |
| ▸ | ITGA5 | P08648 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.36 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.36 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.35 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
| ▸ | ITGAV | P06756 | 1/20 | 0.35 |
| ▸ | KLK7 | P49862 | 2/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GMNN | O75496 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL6688907 | 1.00 | ITGB1 (0.37) | ITGB1ITGA5CA1CA2RIPK1 | |
| SCHEMBL6688913 | 1.00 | ITGB1 (0.37) | ITGB1ITGA5CA1CA2RIPK1 | |
| SCHEMBL6692167 | 0.86 | NFE2L2 (0.44) | NR1H3BCHEMEN1KMT2AKDM4E | |
| SCHEMBL6692165 | 0.86 | NFE2L2 (0.44) | NR1H3BCHEMEN1KMT2AKDM4E | |
| SCHEMBL6692171 | 0.86 | NFE2L2 (0.44) | NR1H3BCHEMEN1KMT2AKDM4E | |
| SCHEMBL6685702 | 0.83 | ALDH1A1 (0.43) | MEN1KMT2AALDH1A1 | |
| SCHEMBL6685695 | 0.83 | ALDH1A1 (0.43) | MEN1KMT2AALDH1A1 | |
| SCHEMBL6685690 | 0.83 | ALDH1A1 (0.43) | MEN1KMT2AALDH1A1 | |
| SCHEMBL6690141 | 0.80 | GPR119 (0.41) | GPR119KMT2ALMNASMN1; SMN2 | |
| SCHEMBL6690143 | 0.80 | GPR119 (0.41) | GPR119KMT2ALMNASMN1; SMN2 |
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-2004089362-A1 | 2-CYANOPYRROLES AND THEIR ANALOGUES AS DDP-IV INHIBITORS | NOVO NORDISK A/S (DK) | 2004-10-21 | — | — | WO | disclosed |