Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.57 |
| ▸ | RAB9A | P51151 | 5/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | PKM | P14618 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | RXRA | P19793 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30576056 | 0.90 | F2 (0.49) | NPC1RAB9APKMTP53ALDH1A1 | |
| SCHEMBL30576180 | 0.88 | POLB (0.47) | NPC1RAB9ASMN1; SMN2PKMALDH1A1 | |
| SCHEMBL30576073 | 0.85 | RAB9A (0.56) | RAB9ASMN1; SMN2ALDH1A1MAPTRXRA | |
| SCHEMBL30576126 | 0.83 | MAPT (0.48) | RAB9ASMN1; SMN2ALDH1A1MAPTRXRA | |
| SCHEMBL30576128 | 0.82 | MAPT (0.55) | NPC1RAB9APKMTP53ALDH1A1 | |
| SCHEMBL30576138 | 0.82 | NPC1 (0.51) | NPC1RAB9ASMN1; SMN2PKMTP53 | |
| SCHEMBL29083767 | 0.82 | RXRA (0.58) | NPC1RAB9APKMTP53ALDH1A1 | |
| SCHEMBL30576104 | 0.81 | DYRK1A (0.54) | NPC1RAB9APKMTP53ALDH1A1 | |
| SCHEMBL30576093 | 0.81 | RXRA (0.46) | MAPTRXRAEGFRWNT1GSK3B | |
| SCHEMBL30576064 | 0.80 | ITGB2 (0.49) | PKMKMT2ALMNAMEN1GSK3B |
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-116836153-B | CDK9-Cyclin T1 protein interaction inhibitor and application thereof | 厦门大学 | 2026-05-19 | — | — | CN | disclosed |
| CN-116836153-A | CDK9-Cyclin T1 protein interaction inhibitor and application thereof | 厦门大学 | 2023-10-03 | — | — | CN | disclosed |