Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 2/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | CETP | P11597 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL24832264 | 1.00 | HDAC3 (0.48) | HDAC3HDAC1HDAC2ALDH1A1ADORA1 | |
| SCHEMBL18399568 | 0.81 | CETP (0.47) | HDAC3HDAC1HDAC2ALDH1A1HPGD | |
| SCHEMBL19059718 | 0.81 | CETP (0.47) | HDAC3HDAC1HDAC2ALDH1A1HPGD | |
| SCHEMBL22853733 | 0.81 | CETP (0.47) | HDAC3HDAC1HDAC2ALDH1A1HPGD | |
| SCHEMBL20368586 | 0.81 | CETP (0.47) | HDAC3HDAC1HDAC2ALDH1A1HPGD | |
| SCHEMBL21781621 | 0.81 | CETP (0.47) | HDAC3HDAC1HDAC2ALDH1A1HPGD | |
| SCHEMBL21158395 | 0.81 | CETP (0.47) | HDAC3HDAC1HDAC2ALDH1A1HPGD | |
| SCHEMBL5849175 | 0.79 | EPHB3 (0.60) | ALDH1A1HPGDNPC1RAB9AKDM4E | |
| SCHEMBL22018172 | 0.78 | IDO1 (0.52) | HDAC3HDAC1HDAC2ALDH1A1HPGD | |
| SCHEMBL20368668 | 0.73 | HDAC3 (0.51) | HDAC3HDAC1HDAC2ALDH1A1ADORA1 |
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-9550765-B2 | Thiazolecarboxamides and pyridinecarboxamide compounds useful as Pim kinase inhibitors | INCYTE HOLDINGS CORPORATION (US) | 2017-01-24 | — | — | US | disclosed |