Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 1/20 | 0.47 |
| ▸ | ITGAV | P06756 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SUV39H2 | Q9H5I1 | 2/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | ACSS2 | Q9NR19 | 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 | |
|---|---|---|---|---|
| SCHEMBL1030227 | 0.89 | ITGB1 (0.46) | ITGB1ITGAVKDM4EALDH1A1HPGD | |
| SCHEMBL3315439 | 0.80 | ITGB1 (0.71) | ITGB1ITGAVCTSL | |
| SCHEMBL3318595 | 0.80 | ITGB1 (0.71) | ITGB1ITGAVCTSL | |
| SCHEMBL4626858 | 0.80 | ITGB1 (0.71) | ITGB1ITGAVCTSL | |
| SCHEMBL4747262 | 0.76 | ITGB1 (0.58) | ITGB1ITGAVKDM4EALDH1A1HPGD | |
| SCHEMBL29231873 | 0.76 | PPARG (0.50) | KDM4EALDH1A1HPGDHTTTRPA1 | |
| SCHEMBL30192895 | 0.76 | PPARG (0.50) | KDM4EALDH1A1HPGDHTTTRPA1 | |
| SCHEMBL3320795 | 0.75 | ITGB1 (0.59) | ITGB1ITGAVCTSL | |
| SCHEMBL1030225 | 0.75 | ITGB1 (0.59) | ITGB1ITGAVCTSL | |
| SCHEMBL4627521 | 0.75 | ITGB1 (0.59) | ITGB1ITGAVCTSL |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008138592-A1 | BICYCLIC AND HETEROBICYCLIC DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES | UCB PHARMA, S.A. (BE) | 2008-11-20 | — | — | WO | disclosed |
| WO-2008125215-A1 | BICYCLIC AND HETEROBICYCLIC DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES | UCB PHARMA, S.A. (BE) | 2008-10-23 | — | — | WO | disclosed |