Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | ACACB | O00763 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31396725 | 1.00 | ALDH1A1 (0.59) | ALDH1A1RAB9AKDM4EATMACACB | |
| SCHEMBL14972574 | 0.88 | MAP4K4 (0.53) | ALDH1A1RAB9AKDM4EATMKMT2A | |
| SCHEMBL3652880 | 0.88 | MAP4K4 (0.53) | ALDH1A1RAB9AKDM4EATMKMT2A | |
| SCHEMBL3650360 | 0.83 | NPSR1 (0.59) | ALDH1A1KDM4EKMT2ASMN1; SMN2HPGD | |
| SCHEMBL164969 | 0.83 | ALDH1A1 (0.60) | ALDH1A1RAB9AKDM4EATMACACB | |
| SCHEMBL164968 | 0.83 | ALDH1A1 (0.60) | ALDH1A1RAB9AATMACACBMEN1 | |
| SCHEMBL14359497 | 0.83 | ATM (0.73) | ALDH1A1RAB9AKDM4EATMACACB | |
| SCHEMBL8536043 | 0.82 | ALDH1A1 (0.53) | ALDH1A1KDM4EATMMEN1KMT2A | |
| SCHEMBL8737626 | 0.81 | HPGD (0.72) | ALDH1A1RAB9AATMACACBMEN1 | |
| SCHEMBL22100076 | 0.81 | ALDH1A1 (0.51) | ALDH1A1KDM4EATMMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-119161360-A | Tricyclic heterocyclic derivative and preparation method and application thereof | 浙江省人民医院 | 2024-12-20 | — | — | CN | disclosed |
| EP-2417120-B1 | SUBSTITUTED PIPERIDINES AS CCR3 ANTAGONISTS | BOEHRINGER INGELHEIM INT (DE) | 2016-10-26 | — | — | EP | disclosed |