Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 8/20 | 0.55 |
| ▸ | RAB9A | P51151 | 8/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | SORT1 | Q99523 | 2/20 | 0.47 |
| ▸ | GRM5 | P41594 | 1/20 | 0.46 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL22574062 | 0.87 | GRM5 (0.54) | NPC1RAB9AKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL22573804 | 0.86 | ATM (0.58) | ATMNPC1RAB9AKMT2APOLB | |
| SCHEMBL22573756 | 0.85 | NPC1 (0.56) | NPC1RAB9AKMT2APOLBSMN1; SMN2 | |
| SCHEMBL22573428 | 0.84 | MEN1 (0.50) | NPC1RAB9AKMT2APOLBSMN1; SMN2 | |
| SCHEMBL22573532 | 0.83 | KDM4E (0.57) | NPC1RAB9AKMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL22573629 | 0.83 | GRM5 (0.63) | ATMNPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL22574013 | 0.83 | CYP3A4 (0.57) | NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL22573749 | 0.82 | IDE (0.54) | ATMNPC1RAB9AKMT2APOLB | |
| SCHEMBL22573273 | 0.81 | HPGDS (0.47) | NPC1RAB9AKMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL22573444 | 0.80 | PRKCI (0.58) | KMT2AALDH1A1LMNAMEN1PTPN11 |
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-3728236-A1 | PYRIMIDINE DERIVATIVES AND THEIR USE USE FOR THE TREATMENT OF CANCER | Adorx therapeutics Limited (GB) | 2020-10-28 | — | — | EP | claimed |
| EP-3728236-A1 | PYRIMIDINE DERIVATIVES AND THEIR USE USE FOR THE TREATMENT OF CANCER | Adorx therapeutics Limited (GB) | 2020-10-28 | — | — | EP | disclosed |