Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 1/20 | 0.35 |
| ▸ | HTR3A | P46098 | 2/20 | 0.35 |
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | RAD52 | P43351 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.33 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10502034 | 0.91 | ALDH1A1 (0.38) | HTR3AKCNH3ALDH1A1TDP1POLB | |
| SCHEMBL1720891 | 0.81 | ALDH1A1 (0.41) | MIFHTR3AALDH1A1TDP1LMNA | |
| SCHEMBL5964912 | 0.78 | MEN1 (0.40) | ALDH1A1MAPK1HTTSMN1; SMN2MEN1 | |
| SCHEMBL1669437 | 0.78 | MEN1 (0.40) | ALDH1A1MAPK1HTTSMN1; SMN2MEN1 | |
| SCHEMBL3542927 | 0.78 | MEN1 (0.40) | ALDH1A1MAPK1HTTSMN1; SMN2MEN1 | |
| SCHEMBL6542019 | 0.78 | MEN1 (0.40) | ALDH1A1MAPK1HTTSMN1; SMN2MEN1 | |
| SCHEMBL96871 | 0.78 | MEN1 (0.40) | ALDH1A1MAPK1HTTSMN1; SMN2MEN1 | |
| SCHEMBL6717183 | 0.78 | MEN1 (0.40) | ALDH1A1MAPK1HTTSMN1; SMN2MEN1 | |
| SCHEMBL6716782 | 0.78 | MEN1 (0.40) | ALDH1A1MAPK1HTTSMN1; SMN2MEN1 | |
| SCHEMBL7794049 | 0.77 | HTR3A (0.39) | HTR3AALDH1A1TDP1RAD52LMNA |
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-0167817-B1 | 8-Alkylthio-2-piperazino-pyrimido[5,4-d]pyrimidines, their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1989-09-20 | — | — | EP | disclosed |
| US-4714698-A | ANTITUMOR, ANTICOAGULANT | DR. KARL THOMAE GMBH (DE) | 1987-12-22 | — | — | US | disclosed |
| EP-0167817-A1 | 8-Alkylthio-2-piperazino-pyrimido[5,4-d]pyrimidines, their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1986-01-15 | — | — | EP | disclosed |