Biotin

Biotin

SCHEMBL15413166

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

nearest known ligand 0.55

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 5/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ ABL1 P00519 1/20 0.55
▸ LMNA P02545 1/20 0.55
▸ PKM P14618 1/20 0.55
▸ IDE P14735 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ RIN1 Q13671 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ FGF1 P05230 1/20 0.48
▸ FGF2 P09038 1/20 0.48
▸ VEGFA P15692 1/20 0.48
▸ HPSE Q9Y251 1/20 0.48
▸ MDK P21741 1/20 0.44
▸ HLCS P50747 3/20 0.42
▸ FOLH1 Q04609 3/20 0.42
▸ CAPN1 P07384 2/20 0.40
▸ CA12 O43570 2/20 0.39
▸ CA1 P00915 2/20 0.39

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 SCHEMBL1270776 0.83 TDP1 (0.72) TDP1MAPK1MEN1ABL1LMNA
Biotin SCHEMBL1270496 0.78 TDP1 (0.61) TDP1MAPK1MEN1ABL1LMNA
Biotin SCHEMBL2510950 0.78 TDP1 (0.61) TDP1MAPK1MEN1ABL1LMNA
SCHEMBL9441198 0.75 MAPK1 (0.48) MAPK1
Biotin SCHEMBL6930604 0.75 TDP1 (0.97) TDP1MAPK1MEN1ABL1LMNA
SCHEMBL42791 0.75 MAPK1 (0.64) MAPK1LMNA
SCHEMBL22163862 0.75 MAPK1 (0.64) MAPK1LMNA
SCHEMBL20533512 0.75 MAPK1 (0.64) MAPK1LMNA
SCHEMBL17184967 0.75 MAPK1 (0.64) MAPK1LMNA
SCHEMBL16241536 0.75 MAPK1 (0.64) MAPK1LMNA

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
EP-2885638-A2 MOLECULAR NETS Sevident, Inc. (US) 2015-06-24 — — EP disclosed
WO-2014011673-A2 MOLECULAR NETS SEVIDENT, INC. (US) 2014-01-16 — — WO disclosed
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