Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 3/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | RAD52 | P43351 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | GALR3 | O60755 | 2/20 | 0.45 |
| ▸ | NR2F2 | P24468 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | APP | P05067 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | UBE2N | P61088 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7951301 | 0.81 | VNN1 (0.50) | EGFRNR2F2KMT2AAPPMAPT | |
| SCHEMBL27857007 | 0.77 | RAD52 (0.56) | ATMRAD52ALDH1A1LMNAKMT2A | |
| SCHEMBL9116416 | 0.75 | EGFR (0.54) | EGFRATMRAD52ALDH1A1CYP1A2 | |
| SCHEMBL9779691 | 0.74 | FABP1 (0.52) | EGFRALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5934943 | 0.73 | RAB9A (0.57) | EGFRALDH1A1CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL28584936 | 0.72 | KCNH3 (0.52) | EGFRALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL1019383 | 0.72 | IP6K1 (0.47) | ATMRAD52ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL8674551 | 0.72 | CDK1 (0.59) | ALDH1A1CYP1A2CYP3A4CYP2D6ALOX15 | |
| SCHEMBL29893789 | 0.71 | RAB9A (0.48) | ATMRAD52ALDH1A1LMNAKMT2A | |
| SCHEMBL6837276 | 0.71 | EGFR (0.57) | EGFRATMRAD52ALDH1A1LMNA |
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-0971925-A1 | PYRIMIDOPYRIMIDINE COMPOUNDS | NEWCASTLE UNIVERSITY VENTURES LIMITED (GB) | 2000-01-19 | — | — | EP | disclosed |
| WO-1998043974-A1 | PYRIMIDOPYRIMIDINE COMPOUNDS | NEWCASTLE UNIVERSITY VENTURES LIMITED (GB) | 1998-10-08 | — | — | WO | disclosed |