Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | MC4R | P32245 | 1/20 | 0.43 |
| ▸ | SCN4A | P35499 | 1/20 | 0.43 |
| ▸ | MC3R | P41968 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11621277 | 0.86 | RAB9A (0.50) | ALDH1A1MAPTHPGDHSD17B10KDM4E | |
| SCHEMBL11619462 | 0.84 | MAPT (0.55) | ALDH1A1MAPTHPGDHSD17B10KDM4E | |
| SCHEMBL9801144 | 0.83 | NLRP3 (0.59) | ALDH1A1MAPTHPGDHSD17B10KDM4E | |
| SCHEMBL11618680 | 0.82 | ALDH1A1 (0.46) | ALDH1A1MAPTHPGDHSD17B10KDM4E | |
| SCHEMBL11622423 | 0.80 | ALDH1A1 (0.46) | ALDH1A1MAPTHPGDHSD17B10KDM4E | |
| SCHEMBL436967 | 0.78 | ALDH1A1 (0.59) | ALDH1A1MAPTHPGDHSD17B10ALOX15 | |
| SCHEMBL9168588 | 0.77 | ALDH1A1 (0.57) | ALDH1A1MAPTHPGDHSD17B10ALOX15 | |
| SCHEMBL10341403 | 0.76 | PTGER1 (0.48) | ALDH1A1HPGDHSD17B10MEN1KMT2A | |
| SCHEMBL11622343 | 0.75 | ALDH1A1 (0.41) | ALDH1A1MAPTHPGDHSD17B10KDM4E | |
| SCHEMBL21480120 | 0.74 | ALDH1A1 (0.50) | ALDH1A1MAPTHPGDHSD17B10ALOX15 |
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 |