Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | UBE2N | P61088 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 4/20 | 0.47 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.46 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11259410 | 0.90 | GAA (0.60) | ALDH1A1HPGDNPSR1SMN1; SMN2KDM4E | |
| SCHEMBL11250314 | 0.86 | KDM4E (0.60) | ALDH1A1HPGDSMN1; SMN2KDM4EPOLB | |
| SCHEMBL11272574 | 0.86 | RAB9A (0.54) | ALDH1A1SMN1; SMN2KDM4EPOLBUBE2N | |
| SCHEMBL2765160 | 0.82 | CDC7 (0.61) | ALDH1A1HPGDSMN1; SMN2KDM4EMAPT | |
| SCHEMBL9832252 | 0.81 | MAPT (0.43) | ALDH1A1HPGDNPSR1SMN1; SMN2CYP1A2 | |
| Acetic Acid SCHEMBL11255640 | 0.80 | RAB9A (0.56) | ALDH1A1HPGDNPSR1SMN1; SMN2CYP1A2 | |
| SCHEMBL3404043 | 0.79 | SMN1; SMN2 (0.60) | ALDH1A1HPGDNPSR1SMN1; SMN2CYP1A2 | |
| SCHEMBL28297256 | 0.79 | CDC7 (0.48) | ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL11263762 | 0.78 | KDM4E (0.45) | ALDH1A1HPGDNPSR1SMN1; SMN2CYP1A2 | |
| SCHEMBL11254605 | 0.78 | RAB9A (0.58) | ALDH1A1HPGDSMN1; SMN2CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| JP-57072975-A | — | — | None | — | — | JP | disclosed |
| JP-S5772975-A | 2-SUBSTITUTED PHENYLTHIAZOLE DERVIATIVE, AND MEDICINE FOR PEPTIC ULCER CONTAINING SAID DERIVATIVE AS ACTIVE COMPONENT | KUREHA CHEM IND CO LTD | 1982-05-07 | — | — | JP | disclosed |