Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR2F2 | P24468 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | SLC29A1 | Q99808 | 3/20 | 0.45 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.45 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.45 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | LTK | P29376 | 1/20 | 0.42 |
| ▸ | JAK3 | P52333 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL12567124 | 0.91 | ABL1 (0.49) | NR2F2NPC1RAB9ASMN1; SMN2SLC29A1 | |
| SCHEMBL12566819 | 0.91 | NPC1 (0.58) | NR2F2NPC1RAB9ASMN1; SMN2SLC29A1 | |
| SCHEMBL20008060 | 0.88 | NR2F2 (0.54) | NR2F2NPC1RAB9ASMN1; SMN2SLC29A1 | |
| SCHEMBL12566837 | 0.81 | CCNA2 (0.43) | NPC1RAB9ASMN1; SMN2CCNA2CDK2 | |
| SCHEMBL12567224 | 0.80 | ADORA3 (0.44) | NPC1RAB9ASMN1; SMN2TSHRNFKB1 | |
| SCHEMBL1796050 | 0.80 | SLC29A1 (0.64) | SLC29A1ADORA3DNPH1 | |
| SCHEMBL13773372 | 0.78 | BCHE (0.54) | SMN1; SMN2CYP3A4NFKB1BLMALDH1A1 | |
| SCHEMBL12566833 | 0.78 | BCHE (0.41) | ALDH1A1 | |
| SCHEMBL20008035 | 0.78 | ABL1 (0.50) | NR2F2NPC1RAB9ASMN1; SMN2TSHR | |
| SCHEMBL12652414 | 0.78 | UBA6 (0.47) | NR2F2 |
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-7951810-B2 | Substituted pyrrolo[2,3-d]pyrimidines as inhibitors of E1 activating enzymes | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2011-05-31 | — | — | US | disclosed |