Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.43 |
| ▸ | MOK | Q9UQ07 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11616315 | 0.98 | KDM4E (0.51) | KDM4EALDH1A1GFERTSHRTDP1 | |
| SCHEMBL11616547 | 0.92 | KDM4E (0.45) | KDM4EALDH1A1GFERTSHRTDP1 | |
| SCHEMBL11617455 | 0.90 | KDM4E (0.47) | KDM4EALDH1A1GFERTSHRTDP1 | |
| SCHEMBL11620424 | 0.90 | KDM4E (0.47) | KDM4EALDH1A1GFERTSHRTDP1 | |
| SCHEMBL11622293 | 0.87 | MOK (0.47) | KDM4EALDH1A1ALOX15MOKL3MBTL1 | |
| SCHEMBL11620159 | 0.83 | RAB9A (0.59) | KDM4EALDH1A1TDP1TP53ALOX15 | |
| SCHEMBL11618875 | 0.82 | RAB9A (0.58) | KDM4EALDH1A1GFERTSHRTDP1 | |
| SCHEMBL11619722 | 0.81 | GAA (0.48) | GFERALOX15GAAFAAH | |
| SCHEMBL11620655 | 0.80 | CNR2 (0.46) | MOKL3MBTL1 | |
| SCHEMBL11620240 | 0.75 | MEN1 (0.38) | ALDH1A1RAB9AGAAL3MBTL1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-4101671-A | ANTIULCEROGENICS | BOEHRINGER INGELHEIM GMBH (DE) | 1978-07-18 | — | — | US | disclosed |
| US-RE29628-E | ANTIULCER, SECRETOLYTICS, ANTITUSSIVE | BOEHRINGER INGELHEIM GMBH (DT) | 1978-05-09 | — | — | US | disclosed |
| US-3950393-A | ANTIULCER, ANTISECRETORY, ANTITUSSIVE AGENTS | BOEHRINGER INGELHEIM GMBH (DT) | 1976-04-13 | — | — | US | disclosed |