Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 9/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9280186 | 0.85 | NAPRT (0.54) | TBXAS1KDM4ELMNATDP1CYP1A2 | |
| SCHEMBL250955 | 0.82 | TDP1 (0.68) | ALDH1A1TDP1CYP3A4PKMSMN1; SMN2 | |
| SCHEMBL3957320 | 0.81 | CYP4F2 (0.55) | TBXAS1ALDH1A1TDP1 | |
| SCHEMBL31556473 | 0.80 | TBXAS1 (0.58) | TBXAS1KDM4EALDH1A1LMNACYP1A2 | |
| Hydrochloric Acid SCHEMBL18230734 | 0.79 | CYP4F2 (0.54) | TBXAS1ALDH1A1TDP1 | |
| SCHEMBL304802 | 0.79 | TDP1 (0.60) | TBXAS1KDM4EALDH1A1LMNATDP1 | |
| Hydrochloric Acid SCHEMBL27552763 | 0.79 | CYP4F2 (0.54) | TBXAS1ALDH1A1TDP1 | |
| SCHEMBL10663309 | 0.79 | TSHR (0.45) | KDM4EALDH1A1TDP1CYP3A4PKM | |
| SCHEMBL8476744 | 0.77 | TBXAS1 (0.55) | TBXAS1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL64891 | 0.77 | TBXAS1 (0.59) | TBXAS1KDM4EALDH1A1LMNACYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0070185-A1 | Preparation of lower alkyl 2-formyl-3-(6-methyl-3-pyridinyl)-propionates | SMITHKLINE BECKMAN CORPORATION (US) | 1983-01-19 | — | — | EP | claimed |
| EP-0070185-A1 | Preparation of lower alkyl 2-formyl-3-(6-methyl-3-pyridinyl)-propionates | SMITHKLINE BECKMAN CORPORATION (US) | 1983-01-19 | — | — | EP | disclosed |
| EP-0070185-A1 | Preparation of lower alkyl 2-formyl-3-(6-methyl-3-pyridinyl)-propionates | SMITHKLINE BECKMAN CORPORATION (US) | 1983-01-19 | — | — | EP | disclosed |
| US-4153795-A | Cobalt pyridyl catalysts for hydroformylation | DIRECTOR-GENERAL OF THE AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 1979-05-08 | — | — | US | disclosed |