SCHEMBL31016482

SCHEMBL31016482

C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 3/20 0.54
▸ CTSS P25774 3/20 0.54
▸ CTSK P43235 3/20 0.54
▸ CTSH P09668 1/20 0.54
▸ CXCR4 P61073 2/20 0.53
▸ IL23R Q5VWK5 5/20 0.52
▸ NPBWR1 P48145 1/20 0.51
▸ GLP1R P43220 4/20 0.50
▸ C5AR1 P21730 1/20 0.50
▸ TUBB4A P04350 1/20 0.49
▸ TUBB P07437 1/20 0.49
▸ TUBA3C P0DPH7 1/20 0.49
▸ TUBA1B P68363 1/20 0.49
▸ TUBA4A P68366 1/20 0.49
▸ TUBB4B P68371 1/20 0.49
▸ TUBB3 Q13509 1/20 0.49
▸ TUBB2A Q13885 1/20 0.49
▸ TUBB8 Q3ZCM7 1/20 0.49
▸ TUBA3E Q6PEY2 1/20 0.49
▸ TUBA1A Q71U36 1/20 0.49

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
SCHEMBL31016486 0.98 CTSL (0.55) CTSLCTSSCTSKCTSHCXCR4
SCHEMBL31016493 0.94 CTSL (0.60) CTSLCTSSCTSKCTSHCXCR4
SCHEMBL31016489 0.94 CTSL (0.60) CTSLCTSSCTSKCTSHCXCR4
SCHEMBL31016485 0.94 CTSL (0.60) CTSLCTSSCTSKCTSHCXCR4
SCHEMBL30861900 0.92 NPBWR1 (0.56) CTSLCTSSCTSKCTSHCXCR4
SCHEMBL29910876 0.92 NPBWR1 (0.56) CTSLCTSSCTSKCTSHCXCR4
SCHEMBL30861896 0.92 NPBWR1 (0.56) CTSLCTSSCTSKCTSHCXCR4
SCHEMBL31016480 0.91 CTSL (0.63) CTSLCTSSCTSKCTSHCXCR4
SCHEMBL31674340 0.91 CCKBR (0.57) IL23RNPBWR1GLP1RC5AR1TUBB4A
SCHEMBL29641048 0.91 IL23R (0.57) IL23RNPBWR1GLP1RC5AR1TUBB4A

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118402973-A Application of Qiya seed peptide and derivatives thereof in cosmetics 上海湃肽生物科技有限公司 2024-07-30 — — CN claimed
CN-118402973-A Application of Qiya seed peptide and derivatives thereof in cosmetics 上海湃肽生物科技有限公司 2024-07-30 — — CN disclosed
Send feedback