Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGDS | O60760 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14979364 | 0.91 | KDM4E (0.44) | TSHRATML3MBTL1HDAC1KDM4E | |
| SCHEMBL14979456 | 0.88 | HDAC1 (0.41) | TSHRHDAC1HDAC2ALDH1A1ITGB3 | |
| SCHEMBL14979305 | 0.84 | KDM4E (0.38) | TSHRATML3MBTL1HDAC1KDM4E | |
| SCHEMBL7787085 | 0.80 | KDM4E (0.61) | TDP1KDM4EHPGDSKDM1AMAOA | |
| SCHEMBL14979304 | 0.80 | KDM4E (0.46) | TSHRATML3MBTL1HDAC1KDM4E | |
| SCHEMBL14979454 | 0.77 | HDAC1 (0.42) | TSHRHDAC1KDM4ESMN1; SMN2KDM1A | |
| SCHEMBL4024280 | 0.72 | PRKACA (0.58) | HDAC1HDAC3HDAC2HDAC10HDAC11 | |
| SCHEMBL4140224 | 0.68 | HTR6 (0.57) | TDP1TSHRL3MBTL1KDM4ESMN1; SMN2 | |
| SCHEMBL6654828 | 0.68 | KDM4E (0.49) | KDM4ESMN1; SMN2ALDH1A1CYP1A2MEN1 | |
| Hydrochloric Acid SCHEMBL27483203 | 0.67 | GNAI3 (0.50) | KDM4ESMN1; SMN2ALDH1A1CYP1A2MEN1 |
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-8450348-B2 | Such as 3-[6-(4-Chloro-phenoxy)-hexylamino]-4-(pyridin-4-ylamino)-cyclobut-3-ene-1,2-dione; cancer, tumors; reduced side effects | FORMA TM, LLC (US) | 2013-05-28 | — | — | US | disclosed |