Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.40 |
| ▸ | ABL1 | P00519 | 2/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.40 |
| ▸ | YES1 | P07947 | 2/20 | 0.40 |
| ▸ | PIM1 | P11309 | 2/20 | 0.40 |
| ▸ | KDR | P35968 | 2/20 | 0.40 |
| ▸ | HIPK1 | Q86Z02 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18739760 | 0.81 | KMT2A (0.46) | ALDH1A1MAPK1TSHRHPGDHSD17B10 | |
| SCHEMBL30808213 | 0.79 | MET (0.46) | ALDH1A1MAPK1KDM4ESMN1; SMN2MAPT | |
| SCHEMBL18739629 | 0.79 | MET (0.47) | ALDH1A1MAPK1TSHRHPGDHSD17B10 | |
| SCHEMBL30808177 | 0.79 | MET (0.47) | ALDH1A1MAPK1TSHRHPGDHSD17B10 | |
| SCHEMBL27191790 | 0.78 | CCNC (0.54) | ALDH1A1MAPK1HPGDHSD17B10KDM4E | |
| SCHEMBL18739157 | 0.77 | PIK3CD (0.41) | ALDH1A1MAPK1ABL1NTRK1YES1 | |
| SCHEMBL18739511 | 0.77 | PIK3CA (0.39) | MAPK1ABL1NTRK1YES1PIM1 | |
| SCHEMBL18739542 | 0.77 | ALDH1A1 (0.41) | ALDH1A1HPGDHSD17B10KDM4EMAPT | |
| SCHEMBL23028473 | 0.76 | CNR2 (0.42) | ALDH1A1MAPK1KDM4EGAAMAPT | |
| SCHEMBL19725176 | 0.76 | CXCR4 (0.44) | ALDH1A1TSHRHPGDHSD17B10KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3359533-B1 | QUINOXALINE AND PYRIDOPYRAZINE DERIVATIVES AS PI3KBETA INHIBITORS | JANSSEN PHARMACEUTICA NV (BE) | 2021-11-17 | — | — | EP | disclosed |
| WO-2017060406-A1 | QUINOXALINE AND PYRIDOPYRAZINE DERIVATIVES AS PI3KBETA INHIBITORS | JANSSEN PHARMACEUTICA NV (BE) | 2017-04-13 | — | — | WO | disclosed |