Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCEH1 | Q6PIU2 | 10/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | PKM | P14618 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL16965115 | 0.86 | RAB9A (0.60) | NCEH1RAB9ATSHRPKMNPC1 | |
| SCHEMBL16965297 | 0.80 | NCEH1 (0.54) | NCEH1RAB9ATSHRPKMNPC1 | |
| SCHEMBL29728586 | 0.80 | NCEH1 (0.54) | NCEH1RAB9ATSHRPKMNPC1 | |
| SCHEMBL8926560 | 0.78 | KDM4E (0.59) | TSHRLMNAALDH1A1KMT2A | |
| SCHEMBL14467975 | 0.78 | NCEH1 (0.53) | NCEH1RAB9ATSHRPKMNPC1 | |
| O-Tolyl Dimethylcarbamate SCHEMBL8927621 | 0.78 | NCEH1 (0.56) | NCEH1RAB9ATSHRPKMNPC1 | |
| SCHEMBL87637 | 0.78 | PTGS2 (0.57) | TSHRLMNAALDH1A1 | |
| SCHEMBL8927725 | 0.77 | ACHE (0.59) | BCHELMNAALDH1A1KMT2A | |
| SCHEMBL31522635 | 0.77 | NCEH1 (0.51) | NCEH1RAB9ATSHRPKMNPC1 | |
| SCHEMBL28540620 | 0.77 | MAOA (0.56) | NCEH1RAB9ATSHRPKMNPC1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4692530-A | Chemical agents | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1987-09-08 | — | — | US | claimed |
| US-5614498-A | OLIGOPEPTIDES, BRONCHDILATORS | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1997-03-25 | — | — | US | disclosed |
| US-5496928-A | Endothelin antagonistic substance | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1996-03-05 | — | — | US | disclosed |
| EP-0555537-A2 | Endothelin antagonistic substance | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1993-08-18 | — | — | EP | disclosed |
| US-4692530-A | Chemical agents | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1987-09-08 | — | — | US | disclosed |