Pha-793887

Pha-793887

SCHEMBL31069494

CC(C)CC(=O)Nc1n[nH]c2c1CN(C(=O)C1CCN(C)CC1)C2(C)C.Cl

nearest known ligand 0.98

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CDK1CDK10CDK11BCDK12CDK13CDK14CDK15CDK16CDK17CDK18CDK19CDK2CDK20CDK3CDK4CDK5CDK6CDK7CDK8CDK9

The experimentally established mechanism targets of Pha-793887. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 known ✓ P24941 20/20 0.98
▸ CDK1 known ✓ P06493 1/20 0.98
▸ CDK4 known ✓ P11802 1/20 0.98
▸ CDK7 known ✓ P50613 1/20 0.98
▸ CDK9 known ✓ P50750 1/20 0.98
▸ CDK3 known ✓ Q00526 1/20 0.98
▸ CDK5 known ✓ Q00535 1/20 0.98
▸ CDK16 known ✓ Q00536 1/20 0.98
▸ CDK13 known ✓ Q14004 1/20 0.98
▸ CDK12 known ✓ Q9NYV4 1/20 0.98
▸ CCNA2 P20248 20/20 0.98
▸ CCNA1 P78396 20/20 0.98
▸ CCNT1 O60563 1/20 0.98
▸ ULK1 O75385 1/20 0.98
▸ PRKD3 O94806 1/20 0.98
▸ PAK4 O96013 1/20 0.98
▸ CCNB1 P14635 1/20 0.98
▸ PHKG2 P15735 1/20 0.98
▸ ERCC2 P18074 1/20 0.98
▸ CCND1 P24385 1/20 0.98

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.

Compoundsimilaritytop predictedshared targets
Pha-793887 SCHEMBL5110328 0.99 CCNA2 (1.00) CCNA2CDK2CCNA1CCNT1ULK1
SCHEMBL24669470 0.87 CCNA2 (0.82) CCNA2CDK2CCNA1CCNT1ULK1
SCHEMBL22272113 0.82 CCNA2 (0.78) CCNA2CDK2CCNA1CCNT1ULK1
SCHEMBL25008205 0.79 CCNA2 (0.66) CCNA2CDK2CCNA1CCNT1ULK1
SCHEMBL24513389 0.78 CCNA2 (0.66) CCNA2CDK2CCNA1CCNT1ULK1
SCHEMBL28427761 0.75 CCNA2 (0.61) CCNA2CDK2CCNA1CCNT1ULK1
SCHEMBL24669016 0.74 CCNA2 (0.59) CCNA2CDK2CCNA1CCNT1ULK1
SCHEMBL28427763 0.73 CCNA2 (0.59) CCNA2CDK2CCNA1CCNT1ULK1
SCHEMBL22355618 0.72 CCNA2 (0.54) CCNA2CDK2CCNA1CCNT1ULK1
SCHEMBL15095340 0.71 CDK2 (0.56) CCNA2CDK2CCNA1CCNT1ULK1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240252688-A1 COMPOSITIONS AND METHODS FOR ENHANCED PROTEIN PRODUCTION HDT BIO CORP. 2024-08-01 — — US disclosed
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