Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Benzoguanamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 4/20 | 0.76 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.76 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.76 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.76 |
| ▸ | POLB | P06746 | 1/20 | 0.76 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.58 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | IKBKB | O14920 | 1/20 | 0.49 |
| ▸ | BRAF | P15056 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Benzoguanamine SCHEMBL28634836 | 0.87 | ADORA2A (1.00) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| Benzoguanamine SCHEMBL27898 | 0.87 | ADORA2A (1.00) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| Benzoguanamine SCHEMBL917182 | 0.87 | ADORA2A (1.00) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| Benzoguanamine SCHEMBL4364795 | 0.87 | ADORA2A (0.68) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| Benzoguanamine SCHEMBL11620040 | 0.85 | ADORA2A (0.95) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| Benzoguanamine SCHEMBL29131394 | 0.85 | ADORA2A (0.95) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| Benzoguanamine SCHEMBL8613754 | 0.85 | ADORA2A (0.95) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| Benzoguanamine SCHEMBL11620035 | 0.85 | ADORA2A (0.70) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| Benzoguanamine SCHEMBL3627859 | 0.83 | ADORA2A (0.83) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| Benzoguanamine SCHEMBL9531963 | 0.83 | ADORA2A (0.83) | ADORA2AADORA1ADORA3ADORA2BPOLB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016019128-A1 | POLYMERS, SUBSTRATES, METHODS FOR MAKING SUCH, AND DEVICES COMPRISING THE SAME | AVERTICA INC. (US) | 2016-02-04 | — | — | WO | disclosed |