Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PDE2A | O00408 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | KIF11 | P52732 | 1/20 | 0.30 |
| ▸ | HTR6 | P50406 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19996855 | 1.00 | MPO (0.41) | MPOALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL20626498 | 0.85 | MPO (0.30) | MPO | |
| SCHEMBL1670392 | 0.82 | PDE2A (0.37) | MPOALDH1A1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL1864503 | 0.78 | HSP90AB1 (0.52) | MPOALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL1669717 | 0.78 | HSP90AA1 (0.45) | MPOALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL11980433 | 0.77 | GAA (0.46) | ALDH1A1KMT2ANPC1RAB9AMAPT | |
| SCHEMBL1859066 | 0.76 | POLB (0.53) | ALDH1A1MEN1KMT2AHPGDPDE2A | |
| SCHEMBL4849398 | 0.70 | HSP90AA1 (0.48) | ALDH1A1MEN1KMT2AHSD17B10HSP90AA1 | |
| SCHEMBL24376789 | 0.69 | HSP90AA1 (0.32) | RAB9AMAPTSMN1; SMN2HSP90AA1HSP90AB1 | |
| SCHEMBL1669217 | 0.67 | ERBB2 (0.39) | RAB9AMAPTSMN1; SMN2HSP90AA1HSP90AB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2694505-B1 | HSP90 INHIBITORS | SLOAN KETTERING INST CANCER RES (US) | 2022-04-27 | — | — | EP | disclosed |