Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PRNP | P04156 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 3/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5050275 | 0.79 | HPGD (0.42) | HPGDNPSR1TSHRMAPK1ATM | |
| Hydrochloric Acid SCHEMBL5724631 | 0.78 | HPGD (0.41) | HPGDNPSR1TSHRMAPK1ATM | |
| SCHEMBL8570240 | 0.78 | HPGD (0.43) | HPGDNPSR1TSHRMAPK1ATM | |
| Hydrochloric Acid SCHEMBL2413233 | 0.78 | HPGD (0.40) | HPGDNPSR1TSHRMAPK1ATM | |
| SCHEMBL9439542 | 0.78 | HPGD (0.67) | HPGDNPSR1TSHRMAPK1ATM | |
| SCHEMBL8564545 | 0.77 | HPGD (0.45) | HPGDNPSR1TSHRMAPK1ATM | |
| SCHEMBL21199747 | 0.77 | POLB (0.46) | HPGDNPSR1TSHRMAPK1ATM | |
| SCHEMBL8982459 | 0.77 | HPGD (0.45) | HPGDNPSR1TSHRMAPK1ATM | |
| SCHEMBL8997380 | 0.77 | CYP4A11 (0.47) | HPGDL3MBTL1ALDH1A1HDAC1HDAC6 | |
| SCHEMBL4197199 | 0.77 | HPGD (0.70) | HPGDNPSR1TSHRMAPK1ATM |
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 |
|---|---|---|---|---|---|---|---|
| US-5354754-A | Antitumor and -carcinogenic agents; treating human epidermoid carcinoma KB | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1994-10-11 | — | — | US | disclosed |
| EP-0418924-A2 | Pyrrolopyrimidines, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1991-03-27 | — | — | EP | disclosed |