Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MMP14 | P50281 | 1/20 | 0.39 |
| ▸ | SOAT2 | O75908 | 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 | |
|---|---|---|---|---|
| SCHEMBL28868752 | 0.88 | SOAT2 (0.46) | KDM4EKMT2AALDH1A1RAB9ANPC1 | |
| SCHEMBL25782416 | 0.86 | KMT2A (0.50) | KDM4EKMT2AALDH1A1RAB9ANPC1 | |
| SCHEMBL7918293 | 0.86 | SOAT2 (0.53) | KDM4EKMT2AALDH1A1HTTSOAT2 | |
| SCHEMBL8389444 | 0.85 | SOAT2 (0.55) | KDM4EALDH1A1HTTSOAT2SOAT1 | |
| SCHEMBL23128456 | 0.83 | KDM4E (0.46) | KDM4EKMT2AALDH1A1RAB9ANPC1 | |
| SCHEMBL17254235 | 0.83 | KDM4E (0.46) | KDM4EKMT2AALDH1A1RAB9ANPC1 | |
| SCHEMBL6542992 | 0.83 | KDM4E (0.46) | KDM4EKMT2AALDH1A1RAB9ANPC1 | |
| SCHEMBL5546312 | 0.79 | KMT2A (0.42) | KDM4EKMT2AALDH1A1RAB9ANPC1 | |
| SCHEMBL5546314 | 0.79 | KMT2A (0.42) | KDM4EKMT2AALDH1A1RAB9ANPC1 | |
| SCHEMBL6244975 | 0.78 | ALDH1A1 (0.44) | KDM4EKMT2AALDH1A1NPSR1CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1993001172-A1 | PALLADIUM-CATALYZED ARYLATION/ALKYLATION OF NON-CONJUGATED DIENES | IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) | 1993-01-21 | — | — | WO | disclosed |
| US-5164518-A | Alkylation, arylation | IOWA STATE UNIVERSITY RESEARCH FONDATION INC. (US) | 1992-11-17 | — | — | US | disclosed |