Biotin

Biotin

SCHEMBL8188769

CCCCCCCCCCCC(N)N.O=C(O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21

nearest known ligand 0.72

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Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 5/20 0.72
▸ MEN1 O00255 1/20 0.72
▸ ABL1 P00519 1/20 0.72
▸ LMNA P02545 1/20 0.72
▸ PKM P14618 1/20 0.72
▸ IDE P14735 1/20 0.72
▸ MAPK1 P28482 1/20 0.72
▸ KMT2A Q03164 1/20 0.72
▸ RIN1 Q13671 1/20 0.72
▸ L3MBTL1 Q9Y468 1/20 0.72
▸ HLCS P50747 6/20 0.68
▸ CA12 O43570 4/20 0.47
▸ CA1 P00915 4/20 0.47
▸ CA2 P00918 4/20 0.47
▸ CA9 Q16790 4/20 0.47
▸ CNR1 P21554 1/20 0.46
▸ FOLH1 Q04609 2/20 0.46

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
Biotin SCHEMBL27482647 0.97 TDP1 (0.74) TDP1MEN1ABL1LMNAPKM
Stearic Acid SCHEMBL10828834 0.91 TDP1 (0.83) TDP1MEN1ABL1LMNAPKM
Biotin SCHEMBL8651197 0.91 TDP1 (0.87) TDP1MEN1ABL1LMNAPKM
Biotin SCHEMBL6033491 0.91 TDP1 (0.87) TDP1MEN1ABL1LMNAPKM
Biotin SCHEMBL8672968 0.90 TDP1 (0.85) TDP1MEN1ABL1LMNAPKM
Biotin SCHEMBL8672971 0.89 TDP1 (0.76) TDP1MEN1ABL1LMNAPKM
Biotin SCHEMBL987288 0.89 TDP1 (0.79) TDP1MEN1ABL1LMNAPKM
Hexanoate SCHEMBL4243024 0.89 TDP1 (0.79) TDP1MEN1ABL1LMNAPKM
Biotin SCHEMBL3518095 0.89 TDP1 (0.87) TDP1MEN1ABL1LMNAPKM
Biotin SCHEMBL27671459 0.89 TDP1 (0.87) TDP1MEN1ABL1LMNAPKM

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
US-6083926-A AGENT COMPRISED OF VITAMIN B12 COVALENTLY COUPLED TO BIOTIN BY WATER-SOLUBLE LINKER THE UNIVERSITY OF WASHINGTON (US) 2000-07-04 — — US disclosed
US-5869465-A BINDING TO CELL SURFACE RECEPTORS AND AFFECTING THEIR TRAFFICKING PATHWAY FOR THE TREATMENT AND DIAGNOSIS OF DISORDERS IN WARM-BLOODED ANIMALS RECEPTAGEN CORPORATION (US) 1999-02-09 — — US disclosed
US-5739287-A BOUND ALSO TO A RECEPTOR MODULATING AGENT TO IMPEDE CELL SURFACE RECEPTOR TRAFFICKING PATHWAYS BY INHIBITING THE RECYCLING OF RECEPTORS TO THE CELL SURFACE; ANTITUMOR AND -CARCINOGENIC AGENTS; LEUKEMIA UNIVERSITY OF WASHINGTON (US) 1998-04-14 — — US disclosed
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