Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 1/20 | 0.55 |
| ▸ | IDH1 | O75874 | 2/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | NQO1 | P15559 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | THRA | P10827 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | BCL2 | P10415 | 1/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.38 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7819859 | 0.86 | CALM1 (0.48) | CALM1IDH1LTA4HNQO1THRA | |
| SCHEMBL11589520 | 0.83 | THRA (0.49) | CALM1IDH1NQO1LMNATHRA | |
| SCHEMBL9193035 | 0.82 | CALM1 (0.48) | CALM1IDH1LTA4HNQO1LMNA | |
| SCHEMBL12815996 | 0.82 | CALM1 (0.40) | CALM1IDH1LTA4HNQO1 | |
| SCHEMBL7918609 | 0.81 | CALM1 (0.52) | CALM1IDH1LTA4HBCL2BCL2L1 | |
| SCHEMBL27509240 | 0.80 | CALM1 (0.52) | CALM1IDH1LTA4HLMNATP53 | |
| SCHEMBL9480008 | 0.80 | HMGB1 (0.55) | CALM1IDH1NQO1ESR1ESR2 | |
| SCHEMBL28888543 | 0.80 | CALM1 (0.52) | CALM1IDH1LTA4HLMNAESR1 | |
| SCHEMBL12815239 | 0.78 | HTR1D (0.40) | CALM1IDH1NQO1THRATHRB | |
| SCHEMBL28993568 | 0.78 | CALM1 (0.39) | CALM1IDH1LTA4HNQO1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0708077-B1 | Diamino compounds and methods for preparing them | CHISSO CORP (JP) | 2000-12-27 | — | — | EP | disclosed |
| US-5663440-A | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1997-09-02 | — | — | US | disclosed |
| EP-0708077-A1 | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1996-04-24 | — | — | EP | disclosed |