Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.59 |
| ▸ | LIPE | Q05469 | 6/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL7479368 | 0.77 | LIPE (0.68) | LIPECYP2C19ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL11881512 | 0.75 | LIPE (0.61) | LIPEMAPTSMN1; SMN2KMT2A | |
| SCHEMBL7488907 | 0.75 | LIPE (0.61) | LIPEALDH1A1MAPTSMN1; SMN2KMT2A | |
| SCHEMBL7456919 | 0.75 | LIPE (0.61) | LIPECYP2C19ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL3700163 | 0.74 | RAB9A (0.67) | KEAP1POLBALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL14890641 | 0.73 | LIPE (0.62) | LIPEALDH1A1MAPTSMN1; SMN2KMT2A | |
| SCHEMBL28450825 | 0.72 | KEAP1 (0.50) | KEAP1POLBALDH1A1MAPTTDP1 | |
| SCHEMBL7551658 | 0.71 | LIPE (0.69) | LIPECYP2C19ALDH1A1TDP1KMT2A | |
| SCHEMBL9109432 | 0.71 | SMN1; SMN2 (0.60) | LIPEALDH1A1MAPTSMN1; SMN2KMT2A | |
| SCHEMBL11244833 | 0.70 | HDAC8 (0.52) | LIPEPOLBCYP2C19ALDH1A1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4362875-A | Process for preparing (1-acylaminomethyl)-1,2,3,4-tetrahydroisoquinolines | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1982-12-07 | — | — | US | disclosed |