Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.62 |
| ▸ | RAB9A | P51151 | 3/20 | 0.62 |
| ▸ | NPC1 | O15118 | 3/20 | 0.62 |
| ▸ | LMNA | P02545 | 5/20 | 0.50 |
| ▸ | GBA1 | P04062 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | MC4R | P32245 | 2/20 | 0.50 |
| ▸ | RAD52 | P43351 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.50 |
| ▸ | SYNJ2 | O15056 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL11674067 | 0.82 | CNR1 (0.50) | ALDH1A1RAB9ANPC1LMNAGBA1 | |
| SCHEMBL11668325 | 0.82 | CNR1 (0.50) | ALDH1A1RAB9ANPC1LMNAGBA1 | |
| SCHEMBL11501627 | 0.82 | CNR1 (0.50) | ALDH1A1RAB9ANPC1LMNAGBA1 | |
| SCHEMBL15740342 | 0.77 | NPC1 (1.00) | ALDH1A1RAB9ANPC1LMNAGBA1 | |
| SCHEMBL9226495 | 0.76 | LMNA (0.78) | ALDH1A1LMNACYP3A4HTTCYP1A2 | |
| SCHEMBL28903630 | 0.72 | SMN1; SMN2 (0.46) | ALDH1A1NPC1LMNAGBA1TP53 | |
| SCHEMBL28349418 | 0.71 | ALDH1A1 (0.57) | ALDH1A1LMNAGBA1TP53CYP3A4 | |
| SCHEMBL11501930 | 0.70 | TMEM97 (0.46) | NPC1LMNAGBA1TP53CYP3A4 | |
| SCHEMBL11071170 | 0.70 | LMNA (0.88) | ALDH1A1LMNACYP3A4HTTCYP1A2 | |
| SCHEMBL17956745 | 0.70 | LMNA (0.88) | ALDH1A1LMNACYP3A4HTTCYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4163022-A | ANTIPLAQUE AGENTS | COOPER LABORATORIES, INC. (US) | 1979-07-31 | — | — | US | disclosed |
| US-4115447-A | Carbamylguanidine antimicrobial compounds | COOPER LABORATORIES, INC. (US) | 1978-09-19 | — | — | US | disclosed |
| US-4115448-A | Carbamylguanidine antimicrobial compounds | COOPER LABORATORIES, INC. (US) | 1978-09-19 | — | — | US | disclosed |
| US-4022962-A | DENTAL PLAQUE INHIBITORS | COOPER LABORATORIES, INC. (US) | 1977-05-10 | — | — | US | disclosed |