Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5380991 | 0.89 | ALOX15 (0.45) | ALOX15TSHRMAPTNPC1RAB9A | |
| SCHEMBL11036130 | 0.75 | NPC1 (0.54) | ALOX15TSHRMAPTNPC1RAB9A | |
| SCHEMBL24555361 | 0.75 | NPC1 (0.54) | ALOX15TSHRMAPTNPC1RAB9A | |
| SCHEMBL3234078 | 0.73 | HPGD (0.43) | ALOX15TSHRMAPTNPC1RAB9A | |
| SCHEMBL29632810 | 0.70 | L3MBTL1 (0.51) | ALOX15TSHRMAPTNPC1RAB9A | |
| SCHEMBL9332923 | 0.69 | TSHR (0.61) | ALOX15TSHRMAPTNPC1RAB9A | |
| SCHEMBL3236799 | 0.69 | LMNA (0.44) | NPC1RAB9AALDH1A1HDAC1TP53 | |
| SCHEMBL9332113 | 0.69 | TSHR (0.53) | ALOX15TSHRMAPTNPC1RAB9A | |
| SCHEMBL24555364 | 0.69 | NPC1 (0.52) | ALOX15TSHRMAPTNPC1RAB9A | |
| SCHEMBL28703267 | 0.69 | SMN1; SMN2 (0.54) | ALOX15TSHRNPC1RAB9AALDH1A1 |
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-2007113644-A2 | NEW HDAC INHIBITORS | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-10-11 | — | — | WO | claimed |
| WO-2007113644-A2 | NEW HDAC INHIBITORS | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-10-11 | — | — | WO | disclosed |