Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.63 |
| ▸ | GAA | P10253 | 1/20 | 0.63 |
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | BLM | P54132 | 1/20 | 0.59 |
| ▸ | AGER | Q15109 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | ASPH | Q12797 | 1/20 | 0.47 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5211190 | 0.79 | SLC18A3 (0.56) | KDM4EALDH1A1GAACYP3A4CYP1A2 | |
| SCHEMBL8183855 | 0.79 | SMN1; SMN2 (0.54) | KDM4EALDH1A1GAAMAPTTSHR | |
| SCHEMBL3055032 | 0.79 | NAPRT (0.54) | KDM4EALDH1A1GAACYP3A4CYP1A2 | |
| SCHEMBL5047657 | 0.79 | SLC18A3 (0.56) | KDM4EALDH1A1GAACYP3A4CYP1A2 | |
| SCHEMBL31432000 | 0.78 | ALDH1A1 (1.00) | KDM4EALDH1A1GAAMAPTCYP3A4 | |
| SCHEMBL30885089 | 0.77 | PARP1 (0.55) | ALDH1A1GAATSHRLMNAKMT2A | |
| SCHEMBL3027381 | 0.76 | ALDH1A1 (0.54) | KDM4EALDH1A1GAAALOX15NPSR1 | |
| SCHEMBL20711523 | 0.76 | KDM4E (0.43) | KDM4EALDH1A1GAATSHRLMNA | |
| Quinolinic Acid SCHEMBL69230 | 0.75 | KDM4E (1.00) | KDM4EALDH1A1GAAMAPTCYP3A4 | |
| Quinolinic Acid SCHEMBL343618 | 0.75 | KDM4E (1.00) | KDM4EALDH1A1GAAMAPTCYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0652218-B1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2001-07-11 | — | — | EP | disclosed |
| US-5585385-A | USEFUL IN TREATING DISORDERS OF MICTURITION; ADMINISTERING TO INHIBIT PLASMA EXTRAVASATION | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-12-17 | — | — | US | disclosed |
| EP-0652218-A1 | Heterocyclic compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1995-05-10 | — | — | EP | disclosed |