Bromide

Bromide

SCHEMBL29634894

Br.CN1CCc2c(cc(O)c(O)c2Cl)[C@@H](c2ccccc2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRA2A known ✓ P08913 2/20 0.79
▸ SIGMAR1 known ✓ Q99720 1/20 0.63
▸ DRD1 P21728 14/20 1.00
▸ DRD2 P14416 8/20 1.00
▸ KDM4E B2RXH2 6/20 0.81
▸ MAPT P10636 5/20 0.81
▸ PMP22 Q01453 5/20 0.81
▸ LMNA P02545 3/20 0.81
▸ MAPK1 P28482 1/20 0.81
▸ CYP2D6 P10635 5/20 0.79
▸ HSD17B10 Q99714 5/20 0.79
▸ THPO P40225 4/20 0.79
▸ TSHR P16473 4/20 0.79
▸ ALOX15 P16050 3/20 0.79
▸ NFKB1 P19838 3/20 0.79
▸ HIF1A Q16665 2/20 0.79
▸ CYP1A2 P05177 4/20 0.77
▸ CYP3A4 P08684 3/20 0.77
▸ MTOR P42345 2/20 0.77
▸ MEN1 O00255 2/20 0.77

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
Bromide SCHEMBL7320300 1.00 DRD1 (1.00) DRD1DRD2KDM4EMAPTPMP22
SCHEMBL7323497 0.99 DRD1 (1.00) DRD1DRD2KDM4EMAPTPMP22
Bromide SCHEMBL11496865 0.90 DRD1 (0.82) DRD1DRD2KDM4EMAPTPMP22
SCHEMBL11099766 0.89 DRD1 (0.82) DRD1DRD2KDM4EMAPTPMP22
Bromide SCHEMBL29634914 0.89 DRD1 (1.00) DRD1DRD2KDM4EMAPTPMP22
Bromide SCHEMBL12610614 0.89 DRD1 (1.00) DRD1DRD2KDM4EMAPTPMP22
SCHEMBL34464664 0.88 DRD1 (0.80) DRD1DRD2KDM4EMAPTPMP22
SCHEMBL14495015 0.87 DRD1 (0.79) DRD1DRD2KDM4EMAPTPMP22
SCHEMBL30231809 0.87 DRD1 (1.00) DRD1DRD2KDM4EMAPTPMP22
SCHEMBL2970804 0.87 DRD1 (1.00) DRD1DRD2KDM4EMAPTPMP22

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
US-20240065999-A1 Ophthalmic Formulation Containing a Dopaminergic Prodrug that may be Combined with One or More Agents THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2024-02-29 — — US disclosed
WO-2022099195-A1 OPHTHALMIC FORMULATION CONTAINING A DOPAMINERGIC PRODRUG THAT MAY BE COMBINED WITH ONE OR MORE AGENTS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2022-05-12 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240065999-A1 Ophthalmic Formulation Containing a Dopaminergic Prodrug that may be Combined with One or More Agents SLC6A3, SLC18A2, SLC6A2 ADRA2A 40/4885SIGMAR1 63/4885DRD1 29/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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