Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.49 |
| ▸ | CSF1R | P07333 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | KIT | P10721 | 5/20 | 0.43 |
| ▸ | KDR | P35968 | 3/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.43 |
| ▸ | FLT4 | P35916 | 1/20 | 0.43 |
| ▸ | ILK | Q13418 | 1/20 | 0.43 |
| ▸ | MAP3K20 | Q9NYL2 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.43 |
| ▸ | BRAF | P15056 | 5/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.42 |
| ▸ | RAF1 | P04049 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL171414 | 0.85 | LOXL2 (0.53) | PARP1ADORA1CSF1RKDR | |
| SCHEMBL14792981 | 0.85 | PARP1 (0.52) | PARP1ADORA1CSF1RTSHRKIT | |
| SCHEMBL169192 | 0.84 | KMT2A (0.54) | PARP1CSF1RTSHRKDRMAPK14 | |
| SCHEMBL171424 | 0.82 | PARP1 (0.49) | PARP1ADORA1CSF1R | |
| SCHEMBL246824 | 0.80 | PARP1 (0.51) | PARP1ADORA1CSF1RKITKDR | |
| SCHEMBL30542691 | 0.80 | PARP1 (0.51) | PARP1ADORA1CSF1RKITKDR | |
| SCHEMBL18922125 | 0.80 | SMYD3 (0.58) | PARP1ADORA1CSF1RKITKDR | |
| SCHEMBL14566951 | 0.79 | KDR (0.48) | PARP1TSHRKDRMAP3K20MAPK14 | |
| SCHEMBL12020808 | 0.79 | RAB9A (0.49) | PARP1CSF1RALDH1A1GAAMAPT | |
| SCHEMBL14009092 | 0.78 | CCNC (0.56) | PARP1CSF1RKITKDRPDGFRB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021016228-A1 | COMBINATION THERAPY FOR TREATING RAS-MUTANT CANCERS | H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE INC. (US) | 2021-01-28 | — | — | WO | disclosed |
| WO-2018081830-A9 | COMBINATIONS OF AGENTS TO TREAT HEMATOLOGICAL MALIGNANCIES | OREGON HEALTH & SCIENCE UNIVERSITY (US) | 2018-06-28 | — | — | WO | disclosed |
| WO-2018081830-A1 | COMBINATIONS OF AGENTS TO TREAT HEMATOLOGICAL MALIGNANCIES | OREGON HEALTH & SCIENCE UNIVERSITY (US) | 2018-05-03 | — | — | WO | disclosed |