Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 2/20 | 0.36 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CCR2 | P41597 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KMO | O15229 | 1/20 | 0.33 |
| ▸ | RARA | P10276 | 1/20 | 0.33 |
| ▸ | RARB | P10826 | 1/20 | 0.33 |
| ▸ | RARG | P13631 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28185749 | 0.86 | RXRA (0.35) | SRD5A1SRD5A2CCR2KMO | |
| SCHEMBL27413672 | 0.86 | RXFP1 (0.35) | KMT2AMEN1ALAD | |
| SCHEMBL27371651 | 0.86 | BCL2L1 (0.38) | PTGS1PTGS2KMT2ACCR2RARA | |
| SCHEMBL27620271 | 0.85 | RXRA (0.32) | — | |
| SCHEMBL27632090 | 0.83 | CA1 (0.39) | NPC1RAB9AKDM4EPOLBSMN1; SMN2 | |
| SCHEMBL27937750 | 0.82 | TAAR1 (0.33) | KDM4ESMN1; SMN2 | |
| SCHEMBL27843061 | 0.80 | SRD5A1 (0.38) | SRD5A1SRD5A2NPC1RAB9ATSHR | |
| SCHEMBL28016450 | 0.80 | KMO (0.45) | PTGS1PTGS2NPC1RAB9APOLB | |
| SCHEMBL27749870 | 0.78 | DHODH (0.34) | — | |
| SCHEMBL27342628 | 0.77 | SRD5A1 (0.33) | SRD5A1SRD5A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105980387-A | Serine/threonine kinase inhibitors | 阵列生物制药公司 | 2016-09-28 | — | — | CN | disclosed |