Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.46 |
| ▸ | MC4R | P32245 | 2/20 | 0.43 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.39 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.39 |
| ▸ | TLK2 | Q86UE8 | 1/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | CCND3 | P30281 | 1/20 | 0.37 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.36 |
| ▸ | TUBB | P07437 | 1/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.36 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.36 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.36 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.36 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8539649 | 0.82 | NOS3 (0.47) | SMPD3MC4RTLK2CDK4CCNA2 | |
| SCHEMBL8536671 | 0.81 | NOS3 (0.46) | SMPD3MC4RTLK2NOS3NOS1 | |
| SCHEMBL8540730 | 0.78 | MC4R (0.46) | SMPD3MC4RALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL8540790 | 0.77 | NISCH (0.37) | SMPD3MC4RNOS3NOS1NOS2 | |
| SCHEMBL8541205 | 0.75 | NISCH (0.36) | SMPD3MC4RALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL8541400 | 0.75 | MC4R (0.37) | MC4RALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8537559 | 0.75 | MC4R (0.44) | SMPD3MC4RALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL8536816 | 0.75 | JAK2 (0.47) | SMPD3MC4RCDK4CCNA2CCND1 | |
| SCHEMBL8540597 | 0.75 | CSNK1A1 (0.36) | SMPD3MC4RP2RX3P2RX2ALDH1A1 | |
| SCHEMBL8541277 | 0.74 | JAK2 (0.44) | SMPD3MC4RCDK4CCNA2CCND1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0857171-A2 | IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-08-12 | — | — | EP | disclosed |
| WO-1997015555-A2 | IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-05-01 | — | — | WO | disclosed |