Pyrrole — predicted protein targets

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	FOLH1	Q04609	1/20	0.54

▸	MMP2	P08253	1/20	0.45

▸	MMP9	P14780	1/20	0.45

▸	CA1	P00915	1/20	0.43

▸	CA2	P00918	1/20	0.43

▸	SLC6A5	Q9Y345	1/20	0.43

▸	SLC15A2	Q16348	1/20	0.43

▸	GSR	P00390	1/20	0.42

▸	RNPEP	Q9H4A4	1/20	0.41

▸	CPB2	Q96IY4	7/20	0.40

▸	ERAP2	Q6P179	2/20	0.38

▸	LNPEP	Q9UIQ6	2/20	0.38

▸	ERAP1	Q9NZ08	1/20	0.38

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
SCHEMBL43996	0.88	FOLH1 (0.66)	FOLH1MMP2MMP9CA1CA2
SCHEMBL43995	0.88	FOLH1 (0.66)	FOLH1MMP2MMP9CA1CA2
SCHEMBL9875634	0.88	FOLH1 (0.66)	FOLH1MMP2MMP9CA1CA2
Pyrrole SCHEMBL15122751	0.88	FOLH1 (0.51)	FOLH1MMP2MMP9CA1CA2
Quinoline SCHEMBL28329241	0.82	PYGL (0.41)	FOLH1MMP2MMP9CA1CA2
SCHEMBL24141430	0.77	FOLH1 (0.54)	FOLH1CA1CA2SLC6A5SLC15A2
SCHEMBL12572609	0.77	FOLH1 (0.83)	FOLH1SLC6A5GSRRNPEPCPB2
SCHEMBL28100804	0.77	FOLH1 (0.47)	FOLH1MMP2MMP9CA1CA2
SCHEMBL2331387	0.77	FOLH1 (0.47)	FOLH1MMP2MMP9CA1CA2
SCHEMBL482959	0.76	FOLH1 (0.65)	FOLH1MMP2MMP9CA1CA2

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-115093376-A	Double/multiple functional unnatural amino acid, conjugate and application thereof	北京大学	2022-09-23	—	—	CN	disclosed