Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
The experimentally established mechanism targets of Pyridine. 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 | |
|---|---|---|---|---|
| ▸ | GRIN1 known ✓ | Q05586 | 1/20 | 0.30 |
| ▸ | GRIN2B known ✓ | Q13224 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | PLOD2 | O00469 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PLOD1 | Q02809 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Pyridine SCHEMBL9258140 | 0.91 | TDP1 (0.43) | TDP1NAPRTTSHRLMNAALDH1A1 | |
| Pyridine SCHEMBL10678990 | 0.90 | NAPRT (0.53) | TDP1NAPRTTSHRLMNAALDH1A1 | |
| Pyridine SCHEMBL28192777 | 0.90 | NAPRT (0.53) | TDP1NAPRTTSHRLMNAALDH1A1 | |
| Benzene SCHEMBL27460903 | 0.90 | NAPRT (0.53) | TDP1NAPRTTSHRLMNAALDH1A1 | |
| Pyridine SCHEMBL546119 | 0.90 | NAPRT (0.53) | TDP1NAPRTTSHRLMNAALDH1A1 | |
| Pyridine SCHEMBL28751369 | 0.87 | NAPRT (0.50) | TDP1NAPRTTSHRLMNAALDH1A1 | |
| Pyridine SCHEMBL8371169 | 0.87 | NAPRT (0.50) | TDP1NAPRTTSHRLMNAALDH1A1 | |
| Pyridine SCHEMBL28275562 | 0.87 | NAPRT (0.50) | TDP1NAPRTTSHRLMNAALDH1A1 | |
| Pyridine SCHEMBL28392625 | 0.85 | NAPRT (0.47) | TDP1NAPRTTSHRLMNAALDH1A1 | |
| Pyridine SCHEMBL29129469 | 0.85 | NAPRT (0.47) | TDP1NAPRTTSHRLMNAALDH1A1 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117310034-B | Detection method of genotoxic impurities in betahistine mesylate | 石家庄四药有限公司 | 2024-12-06 | — | — | CN | disclosed |
| CN-117310034-A | Detection method of genotoxic impurities in betahistine mesylate | 石家庄四药有限公司 | 2023-12-29 | — | — | CN | disclosed |