Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.41 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.41 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.41 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.41 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.40 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.40 |
| ▸ | TTR | P02766 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13907978 | 0.81 | BCL6 (0.45) | ALDH1A1LMNAHSD17B10TDP1BCL6 | |
| SCHEMBL27311098 | 0.80 | LMNA (0.40) | ALDH1A1LMNAHSD17B10TDP1TTR | |
| SCHEMBL6363474 | 0.80 | ALDH1A1 (0.40) | TPMTALDH1A1LMNAGRIK1HSD17B10 | |
| SCHEMBL1758988 | 0.80 | TTR (0.47) | TPMTALDH1A1LMNAGRIK1TTR | |
| SCHEMBL1759139 | 0.80 | BCL6 (0.50) | TPMTALDH1A1LMNAHSD17B10TDP1 | |
| SCHEMBL27311310 | 0.80 | CA12 (0.51) | TPMTALDH1A1LMNAGRIN2DGRIN3B | |
| SCHEMBL6362927 | 0.75 | TDP1 (0.42) | TPMTALDH1A1LMNATDP1GRIN2D | |
| SCHEMBL2257694 | 0.74 | GRIN2D (0.69) | ALDH1A1GRIA1HSD17B10GRIN2DGRIN3B | |
| SCHEMBL3965692 | 0.74 | KDM4E (0.41) | ALDH1A1GRIA1HSD17B10GRIN2DGRIN3B | |
| SCHEMBL1095502 | 0.71 | SIRT2 (0.69) | ALDH1A1LMNAGRIK1GRIA1GRIA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009034029-A2 | 1-SUBSTITUTED 4-HETEROCYCLYLPIPERIDINES FOR USE AS CGRP ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-03-19 | — | — | WO | disclosed |