Known targets — ChEMBL curated mechanism
BTKCACNA1CCACNA1DCACNA1FCACNA1SCACNA2D1CACNA2D2DRD2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQHRH1HTR2AP2RY12
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KAT6A | Q92794 | 3/20 | 0.41 |
| ▸ | P4HTM | Q9NXG6 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | KDM6B | O15054 | 1/20 | 0.40 |
| ▸ | KDM4A | O75164 | 1/20 | 0.40 |
| ▸ | KDM5C | P41229 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.40 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7052759 | 0.83 | KDM4E (0.50) | SMN1; SMN2P4HTMKDM4ECYP1A2OPRD1 | |
| SCHEMBL7052857 | 0.81 | TSHR (0.44) | TSHRSMN1; SMN2KAT6AP4HTMKDM4E | |
| SCHEMBL11291069 | 0.73 | KAT6A (0.57) | TSHRSMN1; SMN2KAT6AP4HTMKDM4E | |
| Dipyridyl SCHEMBL27903420 | 0.71 | KDM4E (0.70) | SMN1; SMN2P4HTMKDM4EKDM6BKDM4A | |
| SCHEMBL9113917 | 0.71 | SMN1; SMN2 (0.47) | SMN1; SMN2P4HTMKDM4ECYP1A2OPRD1 | |
| SCHEMBL27736665 | 0.71 | CYP1A2 (0.47) | SMN1; SMN2P4HTMKDM4ECYP1A2OPRD1 | |
| SCHEMBL19225619 | 0.70 | KDM4E (0.50) | TSHRSMN1; SMN2KAT6AP4HTMKDM4E | |
| Dipyridyl SCHEMBL17165043 | 0.69 | KDM4E (0.67) | TSHRSMN1; SMN2P4HTMKDM4EKDM6B | |
| Dipyridyl SCHEMBL31482442 | 0.69 | KDM4E (0.67) | TSHRSMN1; SMN2P4HTMKDM4EKDM6B | |
| SCHEMBL1177114 | 0.69 | PTGS2 (0.64) | TSHRMEN1KMT2ADHODHPOLB |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0979820-B1 | 2-Phenylpyridine derivatives and production method thereof | SUMIKA FINE CHEMICALS CO LTD (JP) | 2003-05-07 | — | — | EP | disclosed |
| US-6268503-B1 | REACTING 2-(4-BROMOMETHYLPHENYL)PYRIDINE SALT OR 2-(4-DIBROMOMETHYLPHENYL)PYRIDINE WITH HEXAMETHYLENETETRAMINE AND WATER TO PROVIDE 4-(PYRIDIN-2-YL)BENZALDEHYDE | SUMIKA FINE CHEMICALS CO., LTD. (JP) | 2001-07-31 | — | — | US | disclosed |
| US-6242608-B1 | REACTING 4-(PYRIDIN-2-YL)BENZALDEHYDE WITH HYDRAZINE TO FORM 4-(PYRIDIN-2-YL)BENZALDEHYDE HYDRAZONE; CHEMICAL INTERMEDIATE TO AN ANTI-HIV DRUG | SUMIKA FINE CHEMICALS CO., LTD. (JP) | 2001-06-05 | — | — | US | disclosed |
| US-6147218-A | 2-phenylpyridine derivative and production method thereof | SUMIKA FINE CHEMICALS CO., LTD. (JP) | 2000-11-14 | — | — | US | disclosed |
| EP-0979820-A1 | 2-Phenylpyridine derivatives and production method thereof | SUMIKA FINE CHEMICALS Co., Ltd. (JP) | 2000-02-16 | — | — | EP | disclosed |