Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.42 |
| ▸ | TACR1 | P25103 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | KRAS | P01116 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.40 |
| ▸ | TUBB | P07437 | 1/20 | 0.40 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.40 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.40 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.40 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.40 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.40 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.40 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.40 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7275717 | 0.85 | TACR1 (0.47) | SMN1; SMN2ALDH1A1HPGDKCNH2TACR1 | |
| Hydrochloric Acid SCHEMBL7267243 | 0.84 | TACR1 (0.47) | SMN1; SMN2ALDH1A1HPGDKCNH2TACR1 | |
| SCHEMBL7273027 | 0.81 | CDK8 (0.47) | SMN1; SMN2ALDH1A1L3MBTL1MAPK1KRAS | |
| SCHEMBL9750661 | 0.79 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1L3MBTL1KRASATM | |
| SCHEMBL6596311 | 0.76 | SMN1; SMN2 (0.40) | SMN1; SMN2ALDH1A1KCNH2L3MBTL1NPSR1 | |
| SCHEMBL6596131 | 0.72 | TUBB4A (0.40) | SMN1; SMN2ALDH1A1KCNH2L3MBTL1KRAS | |
| SCHEMBL9750679 | 0.71 | SCN1A (0.49) | ALDH1A1L3MBTL1MAPK1TUBB4ATUBB | |
| Hydrochloric Acid SCHEMBL9750754 | 0.71 | HPGD (0.55) | SMN1; SMN2ALDH1A1HPGDKCNH2NPSR1 | |
| SCHEMBL7273776 | 0.71 | L3MBTL1 (0.59) | SMN1; SMN2ALDH1A1L3MBTL1MAPK1GAA | |
| Hydrochloric Acid SCHEMBL9750696 | 0.70 | SCN1A (0.48) | SMN1; SMN2ALDH1A1L3MBTL1MAPK1TUBB4A |
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-0293925-B1 | COMPOUND ACTIVE IN CARDIOVASCULAR THERAPY | SIMES, SOCIETA ITALIANA MEDICINALI E SINTETICI, S.P.A. (IT) | 1991-10-16 | — | — | EP | disclosed |
| US-4988735-A | Ethylene diamine active cardiovascular therapy | SIMES (IT) | 1991-01-29 | — | — | US | disclosed |
| EP-0293925-A2 | Compound active in cardiovascular therapy | SIMES, SOCIETA ITALIANA MEDICINALI E SINTETICI, S.P.A. (IT) | 1988-12-07 | — | — | EP | disclosed |