Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.39 |
| ▸ | LMNA | P02545 | 6/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 6/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | JAK3 | P52333 | 2/20 | 0.35 |
| ▸ | SOS1 | Q07889 | 5/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.35 |
| ▸ | TP53 | P04637 | 3/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4569334 | 0.83 | KDM4E (0.41) | KDM4EHTTSMN1; SMN2EGFRJAK2 | |
| SCHEMBL16269981 | 0.69 | PIK3CD (0.38) | LMNASMN1; SMN2SOS1ALDH1A1 | |
| SCHEMBL4569338 | 0.69 | PIK3CD (0.38) | MEN1KMT2AKDM4EHTTSMN1; SMN2 | |
| SCHEMBL4569397 | 0.68 | PIK3CD (0.40) | CYP1A2CYP3A4LMNACYP2D6HIF1A | |
| SCHEMBL14329217 | 0.68 | PIK3CD (0.40) | CYP1A2CYP3A4LMNACYP2D6HIF1A | |
| SCHEMBL4569391 | 0.68 | PIK3CD (0.42) | SOS1 | |
| SCHEMBL4569416 | 0.68 | ELANE (0.41) | CYP1A2CYP3A4CYP2D6HSD17B10KDM4E | |
| SCHEMBL4569341 | 0.67 | PIK3CD (0.45) | CYP1A2CYP3A4LMNACYP2D6HIF1A | |
| SCHEMBL4569336 | 0.66 | PIK3CD (0.41) | LMNAKDM4EHTTEGFRALDH1A1 | |
| SCHEMBL3699149 | 0.66 | LMNA (0.39) | LMNAMEN1KMT2AKDM4EHTT |
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-2012064973-A2 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | INFINITY PHARMACEUTICALS, INC. (US) | 2012-05-18 | — | — | WO | disclosed |