Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CTRC | Q99895 | 1/20 | 0.36 |
| ▸ | NQO1 | P15559 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | BCL2 | P10415 | 1/20 | 0.35 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.35 |
| ▸ | TYMP | P19971 | 1/20 | 0.35 |
| ▸ | SHBG | P04278 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | LTA4H | P09960 | 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 | |
|---|---|---|---|---|
| SCHEMBL1841464 | 0.78 | CALM1 (0.61) | CALM1ALDH1A1TRPA1TSHRNQO1 | |
| SCHEMBL16054535 | 0.77 | CALM1 (0.42) | CALM1ALDH1A1TRPA1TSHRCTRC | |
| SCHEMBL27277755 | 0.77 | IDH1 (0.45) | CALM1ALDH1A1TRPA1TSHRNQO1 | |
| SCHEMBL593991 | 0.75 | CALM1 (0.41) | CALM1ALDH1A1TRPA1TSHRMEN1 | |
| SCHEMBL2820256 | 0.74 | CALM1 (0.73) | CALM1ALDH1A1TRPA1TSHRKDM4E | |
| SCHEMBL7669757 | 0.74 | CALM1 (0.44) | CALM1ALDH1A1TRPA1TSHRKDM4E | |
| SCHEMBL29029452 | 0.72 | ALDH1A1 (0.40) | CALM1ALDH1A1TRPA1TSHRCTRC | |
| SCHEMBL7632931 | 0.72 | BCL2 (0.45) | CALM1BCL2BCL2L1MEN1KMT2A | |
| SCHEMBL27286175 | 0.72 | ALDH1A1 (0.48) | CALM1ALDH1A1CTRCNQO1TDP1 | |
| SCHEMBL29029437 | 0.71 | TSHR (0.39) | CALM1TSHRTDP1BCL2BCL2L1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2368892-A1 | NOVEL COMPOUND, PROCESS FOR PRODUCING THE COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL, AND ORGANIC SEMICONDUCTOR DEVICE | Hiroshima University (JP) | 2011-09-28 | — | — | EP | disclosed |