Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | G6PD | P11413 | 1/20 | 0.34 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.34 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | PTPRB | P23467 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11620572 | 0.87 | ALDH1A1 (0.43) | ALDH1A1RAB9AMEN1KMT2ALMNA | |
| Hydrochloric Acid SCHEMBL11619273 | 0.84 | HPGD (0.43) | ALDH1A1RAB9AMEN1KMT2ALMNA | |
| SCHEMBL11624476 | 0.82 | MEN1 (0.45) | ALDH1A1MEN1KMT2ALMNANPC1 | |
| SCHEMBL11620053 | 0.81 | ALDH1A1 (0.39) | ALDH1A1RAB9AMEN1KMT2ALMNA | |
| SCHEMBL2917221 | 0.80 | ALDH1A1 (0.61) | ALDH1A1RAB9AMEN1KMT2ALMNA | |
| SCHEMBL11616005 | 0.80 | ALDH1A1 (0.37) | ALDH1A1RAB9AMEN1KMT2ALMNA | |
| Hydrochloric Acid SCHEMBL11622252 | 0.80 | ALDH1A1 (0.39) | ALDH1A1MEN1KMT2ALMNAKDM4E | |
| SCHEMBL11622343 | 0.79 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2ALMNAKDM4E | |
| Hydrochloric Acid SCHEMBL11626361 | 0.79 | ALDH1A1 (0.37) | ALDH1A1RAB9AMEN1KMT2ALMNA | |
| SCHEMBL11621243 | 0.77 | RAB9A (0.36) | ALDH1A1RAB9AMEN1KMT2ALMNA |
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 |