Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.54 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.49 |
| ▸ | CDK9 | P50750 | 1/20 | 0.49 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.49 |
| ▸ | DYRK1A | Q13627 | 8/20 | 0.43 |
| ▸ | CLK1 | P49759 | 6/20 | 0.43 |
| ▸ | CLK2 | P49760 | 6/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 6/20 | 0.43 |
| ▸ | DYRK1B | Q9Y463 | 6/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 5/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 5/20 | 0.43 |
| ▸ | CLK3 | P49761 | 4/20 | 0.43 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | TNF | P01375 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL31354899 | 0.98 | HTT (0.58) | HTTNCOA3CCNT1CDK9HASPIN | |
| SCHEMBL2011043 | 0.80 | HTT (0.42) | HTTNCOA3CCNT1CDK9HASPIN | |
| SCHEMBL7015267 | 0.78 | HTT (0.73) | HTTNCOA3CCNT1CDK9HASPIN | |
| SCHEMBL1551634 | 0.78 | HTT (0.61) | HTTNCOA3DYRK1ACLK1CLK2 | |
| SCHEMBL31588148 | 0.78 | HTT (0.61) | HTTNCOA3DYRK1ACLK1CLK2 | |
| SCHEMBL27600515 | 0.76 | HTT (0.59) | HTTNCOA3DYRK1ACDK5CDK5R1 | |
| Hydrochloric Acid SCHEMBL11816471 | 0.76 | HTT (0.59) | HTTNCOA3DYRK1ACDK5CDK5R1 | |
| SCHEMBL1202005 | 0.74 | HTT (1.00) | HTTNCOA3CCNT1CDK9HASPIN | |
| SCHEMBL29546988 | 0.73 | HTT (0.50) | HTTNCOA3CCNT1CDK9HASPIN | |
| SCHEMBL20043 | 0.73 | HTT (0.50) | HTTNCOA3CCNT1CDK9HASPIN |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4412710-A1 | SMALL MOLECULES FOR TREATEMENT OF CANCER | Vrise Therapeutics, Inc. (US) | 2024-08-14 | — | — | EP | claimed |
| WO-2023057985-A1 | SMALL MOLECULES FOR TREATEMENT OF CANCER | VRISE THERAPEUTICS, INC. (US) | 2023-04-13 | — | — | WO | claimed |
| WO-2023285583-A1 | 5,6,7,8-TETRAHYDRO-2,6- AND 2,7-NAPHTHYRIDINE DERIVATIVES FOR USE IN THE TREATMENT OF DISEASES RESPONSIVE TO CITRATE TRANSPORTER MODULATION | ETERNYGEN UK LTD. (GB) | 2023-01-19 | — | — | WO | disclosed |