Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.60 |
| ▸ | NAMPT | P43490 | 2/20 | 0.55 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.54 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.54 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.54 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 8/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.52 |
| ▸ | MEN1 | O00255 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | CASP3 | P42574 | 1/20 | 0.52 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.52 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL273218 | 0.93 | PDK1 (0.60) | NAMPTPDK1PDK2PDK3PDK4 | |
| SCHEMBL132701 | 0.86 | CYP17A1 (0.76) | CYP17A1NAMPTTSHR | |
| SCHEMBL14379115 | 0.83 | CYP17A1 (0.68) | CYP17A1NAMPTRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL19945896 | 0.83 | PDK1 (0.50) | NAMPTPDK1PDK2PDK3PDK4 | |
| SCHEMBL10361607 | 0.81 | CYP17A1 (0.61) | CYP17A1NAMPTRAB9ASMN1; SMN2 | |
| SCHEMBL7143564 | 0.81 | MEN1 (0.64) | PDK1PDK2PDK3PDK4TSHR | |
| SCHEMBL10249437 | 0.80 | CYP17A1 (0.68) | CYP17A1NAMPTRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL10941324 | 0.80 | NAMPT (0.69) | NAMPTTSHRRAB9ANPC1MAPT | |
| SCHEMBL3905352 | 0.80 | HTT (0.59) | NAMPTRAB9ANPC1MAPTSMN1; SMN2 | |
| SCHEMBL15709727 | 0.80 | LMNA (0.62) | CYP17A1TSHRMAPTSMN1; SMN2MEN1 |
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-1998035982-A1 | COMPOUNDS FOR USE IN ADEPT | ZENECA LIMITED (GB) | 1998-08-20 | — | — | WO | disclosed |