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Afamelanotide

Afamelanotide

SCHEMBL29419548

CCCCC(NC(=O)C(CO)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CO)NC(C)=O)C(=O)NC(CCC(=O)O)C(=O)NC(Cc1c[nH]cn1)C(=O)NC(Cc1ccccc1)C(=O)NC(CCCNC(=N)N)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCC(=O)NC(CCCCN)C(=O)N1CCCC1C(=O)NC(C(N)=O)C(C)C

nearest known ligand 0.81

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MC1R

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

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MC1R known ✓ Q01726 2/20 0.81
▸ MC4R P32245 3/20 0.81
▸ MC5R P33032 2/20 0.81
▸ MC3R P41968 2/20 0.81
▸ C5AR1 P21730 2/20 0.72
▸ IL23R Q5VWK5 3/20 0.65
▸ CTSL P07711 3/20 0.62
▸ CTSS P25774 3/20 0.62
▸ CTSK P43235 3/20 0.62
▸ CTSH P09668 1/20 0.62
▸ NMBR P28336 1/20 0.61
▸ GRPR P30550 1/20 0.61
▸ TFPI P10646 2/20 0.60
▸ CXCR4 P61073 4/20 0.60
▸ GLP1R P43220 1/20 0.59

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
Afamelanotide SCHEMBL22463810 1.00 MC4R (0.81) MC4RMC5RMC3RMC1RC5AR1
Afamelanotide SCHEMBL22463811 1.00 MC4R (0.81) MC4RMC5RMC3RMC1RC5AR1
Afamelanotide SCHEMBL29352792 1.00 MC4R (0.81) MC4RMC5RMC3RMC1RC5AR1
Afamelanotide SCHEMBL29533175 1.00 MC4R (0.80) MC4RMC5RMC3RMC1RC5AR1
SCHEMBL29970570 0.98 MC4R (0.77) MC4RMC5RMC3RMC1RC5AR1
SCHEMBL18281742 0.96 MC4R (0.77) MC4RMC5RMC3RMC1RC5AR1
SCHEMBL30312751 0.96 MC4R (0.77) MC4RMC5RMC3RMC1RC5AR1
SCHEMBL29533782 0.96 C5AR1 (0.77) MC4RMC5RMC3RMC1RC5AR1
SCHEMBL18281737 0.96 MC4R (0.77) MC4RMC5RMC3RMC1RC5AR1
Intermedine SCHEMBL20548027 0.96 MC4R (0.82) MC4RMC5RMC3RMC1RC5AR1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024040167-A2 SELECTIVE MC4R LIGAND FOR TREATING OBESITY AND COGNITIVE LOSS ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2024-02-22 — — WO disclosed
EP-4236981-A1 PEPTIDES FOR USE IN SKIN AND HAIR PIGMENTATION Follicum AB (SE) 2023-09-06 — — EP disclosed
WO-2022090413-A1 PEPTIDES FOR USE IN SKIN AND HAIR PIGMENTATION FOLLICUM AB (SE) 2022-05-05 — — WO disclosed
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