Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.53 |
| ▸ | PKM | P14618 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.53 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.51 |
| ▸ | FLT1 | P17948 | 1/20 | 0.51 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL30277951 | 0.82 | NPC1 (0.67) | PDPK1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL717809 | 0.82 | NPC1 (0.67) | PDPK1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL3537735 | 0.81 | PDPK1 (1.00) | PDPK1FGFR1FLT1CHEK1CDK2 | |
| SCHEMBL9725328 | 0.76 | PDPK1 (0.61) | PDPK1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL5951751 | 0.75 | PDPK1 (0.80) | PDPK1FGFR1FLT1CHEK1CDK2 | |
| SCHEMBL28114190 | 0.75 | PDPK1 (0.60) | PDPK1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL3741834 | 0.74 | PTGES (0.55) | PDPK1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL31429607 | 0.74 | AMY1A (0.62) | PDPK1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL481735 | 0.74 | NPC1 (0.72) | ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL1284008 | 0.73 | KDM4E (0.67) | PDPK1ALDH1A1SMN1; SMN2NPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5597921-A | ANTITUMOR AGENTS, TREATMENT OF LEUKEMIA | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 1997-01-28 | — | — | US | disclosed |
| EP-0695754-A1 | INDOLO 2,3-b]QUINOXALINE DERIVATIVE | TAISHO PHARMACEUTICAL CO. LTD (JP) | 1996-02-07 | — | — | EP | disclosed |