Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 3/20 | 0.55 |
| ▸ | GALR3 | O60755 | 2/20 | 0.55 |
| ▸ | NR2F2 | P24468 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | RAD52 | P43351 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | UBE2N | P61088 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.51 |
| ▸ | PDE5A | O76074 | 4/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL6477749 | 0.98 | EGFR (0.57) | EGFRGALR3NR2F2RAB9AUTS2R | |
| SCHEMBL31098952 | 0.98 | EGFR (0.57) | EGFRGALR3NR2F2RAB9AUTS2R | |
| SCHEMBL10055014 | 0.93 | WNT3A (0.54) | EGFRGALR3NR2F2RAB9AUTS2R | |
| SCHEMBL10055013 | 0.86 | WNT3A (0.48) | EGFRGALR3NR2F2RAB9AUTS2R | |
| SCHEMBL9927462 | 0.84 | CYP1A2 (0.56) | EGFRRAB9ALMNATSHRMAPK1 | |
| SCHEMBL509566 | 0.82 | EGFR (0.64) | EGFRNR2F2MAPK1KMT2AKDM4E | |
| SCHEMBL8370748 | 0.82 | AURKA (0.52) | EGFRUTS2RAPPGRM4WNT3A | |
| SCHEMBL9374978 | 0.82 | RAB9A (0.59) | EGFRRAB9AUTS2RLMNAMAPK1 | |
| SCHEMBL29647714 | 0.82 | HDAC6 (0.62) | — | |
| SCHEMBL19631286 | 0.82 | HDAC6 (0.62) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0393926-B1 | 1-Aminoisoquinoline derivatives | SMITHKLINE BEECHAM INTERCREDIT (NL) | 1994-09-21 | — | — | EP | disclosed |
| US-5200417-A | Administering to inhibait gastric acid secretion in mammals | SMITHKLINE BEECHAM INTERCREDIT B.V. (GB) | 1993-04-06 | — | — | US | disclosed |
| EP-0393926-A1 | 1-Aminoisoquinoline derivatives | SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) | 1990-10-24 | — | — | EP | disclosed |