Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11620162 | 0.87 | MEN1 (0.44) | ALDH1A1KDM4EKMT2AMEN1ABL1 | |
| SCHEMBL11623005 | 0.86 | SLC2A1 (0.44) | ALDH1A1KDM4EKMT2AMEN1SLC2A1 | |
| SCHEMBL11621081 | 0.80 | ALOX15 (0.58) | ALDH1A1KDM4EKMT2AMEN1ABL1 | |
| SCHEMBL11624836 | 0.73 | SLC2A1 (0.44) | ALDH1A1KDM4EKMT2AMEN1ALOX15 | |
| Hydrochloric Acid SCHEMBL11621332 | 0.72 | SLC2A1 (0.46) | ALDH1A1KDM4EKMT2AMEN1ALOX15 | |
| SCHEMBL11704518 | 0.72 | MEN1 (0.42) | ALDH1A1KDM4EKMT2AMEN1ABL1 | |
| SCHEMBL11700160 | 0.71 | ALOX15 (0.50) | ALDH1A1KDM4EKMT2AMEN1ABL1 | |
| SCHEMBL8856963 | 0.68 | CA12 (0.53) | ALDH1A1KDM4EKMT2AMEN1MAPT | |
| SCHEMBL11619594 | 0.68 | SLC2A1 (0.51) | ALDH1A1KDM4EKMT2AMEN1ALOX15 | |
| SCHEMBL8195063 | 0.67 | CA12 (0.55) | KDM4EKMT2AMEN1CYP1A2CYP2C9 |
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-RE29628-E | ANTIULCER, SECRETOLYTICS, ANTITUSSIVE | BOEHRINGER INGELHEIM GMBH (DT) | 1978-05-09 | — | — | US | disclosed |
| US-4006246-A | ANTIULCER, SECRETOLYTIC, ANTITUSSIVE, STIMULANT | BOEHRINGER INGELHEIM GMBH (DT) | 1977-02-01 | — | — | US | disclosed |
| US-3950393-A | ANTIULCER, ANTISECRETORY, ANTITUSSIVE AGENTS | BOEHRINGER INGELHEIM GMBH (DT) | 1976-04-13 | — | — | US | disclosed |