Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | RXRA | P19793 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KMO | O15229 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 3/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18145102 | 0.71 | OPRM1 (0.39) | TDP1OPRD1OPRM1KDM1ASMYD3 | |
| SCHEMBL3837866 | 0.67 | OPRD1 (0.42) | TDP1RXRAOPRD1OPRM1ALDH1A1 | |
| SCHEMBL3836335 | 0.66 | OPRD1 (0.36) | TDP1RXRAOPRD1ALDH1A1MAPK1 | |
| Hydrochloric Acid SCHEMBL1814403 | 0.64 | OPRD1 (0.36) | TDP1RXRAOPRD1 | |
| SCHEMBL18153948 | 0.64 | HRH3 (0.57) | — | |
| SCHEMBL2175673 | 0.63 | RXRA (0.56) | TDP1RXRAKDM4EMAPTKDM1A | |
| Piperidine SCHEMBL11861125 | 0.63 | KDM4E (0.42) | TDP1RXRAKDM4EMAPTALDH1A1 | |
| SCHEMBL30948434 | 0.62 | ALDH1A1 (0.46) | TDP1RXRAKDM4EMAPTKDM1A | |
| SCHEMBL30948433 | 0.62 | ALDH1A1 (0.46) | TDP1RXRAKDM4EMAPTKDM1A | |
| SCHEMBL743920 | 0.61 | HDAC3 (0.61) | KDM4EOPRD1 |
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-2016168660-A1 | 3-SPIRO-7-HYDROXAMIC ACID TETRALINS AS HDAC INHIBITORS | FORMA THERAPEUTICS, INC. (US) | 2016-10-20 | — | — | WO | disclosed |