Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLO1 | Q04760 | 2/20 | 0.64 |
| ▸ | LMNA | P02545 | 5/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.51 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.51 |
| ▸ | PGR | P06401 | 1/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.51 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL10386679 | 1.00 | GLO1 (0.64) | GLO1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10765527 | 0.89 | GLO1 (0.62) | GLO1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10765529 | 0.89 | GLO1 (0.62) | GLO1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27279415 | 0.85 | SMN1; SMN2 (0.55) | LMNASMN1; SMN2MAPTTDP1TSHR | |
| SCHEMBL10481063 | 0.84 | GLO1 (0.75) | GLO1LMNASMN1; SMN2MAPTNPC1 | |
| SCHEMBL10481060 | 0.84 | GLO1 (0.75) | GLO1LMNASMN1; SMN2MAPTNPC1 | |
| SCHEMBL7384401 | 0.83 | GLO1 (0.68) | GLO1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7384404 | 0.83 | GLO1 (0.68) | GLO1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9401908 | 0.81 | GLO1 (0.82) | GLO1LMNACYP3A4CYP2C9SMN1; SMN2 | |
| SCHEMBL9401912 | 0.81 | GLO1 (0.82) | GLO1LMNACYP3A4CYP2C9SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0245680-A2 | A process for the preparation of 2-(N-benzyl-N-methylamino)-ethyl-methyl-1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridine dicarboxylate hydrochloride | ISTITUTO LUSO FARMACO D'ITALIA S.p.A. (IT) | 1987-11-19 | — | — | EP | disclosed |
| US-4621082-A | Pyridopyrimidines, pharmaceutical compositions and use | BAYER AKTIENGESELLSCHAFT (DE) | 1986-11-04 | — | — | US | disclosed |