Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.40 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NHERF1 | O14745 | 2/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.38 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | NOS3 | P29474 | 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 | |
|---|---|---|---|---|
| SCHEMBL2487614 | 0.85 | TRPV1 (0.40) | ALDH1A1HPGDSIGMAR1GAAGRIN2D | |
| SCHEMBL7421821 | 0.84 | GRIN2D (0.40) | ALDH1A1HPGDSIGMAR1GAAGRIN2D | |
| SCHEMBL6700720 | 0.82 | GRIN2D (0.39) | ALDH1A1HPGDSIGMAR1GAAGRIN2D | |
| SCHEMBL8029769 | 0.82 | MAPT (0.59) | ALDH1A1HPGDSIGMAR1GAAGRIN2D | |
| SCHEMBL13892090 | 0.82 | GRIN2D (0.39) | ALDH1A1HPGDSIGMAR1GAAGRIN2D | |
| SCHEMBL7837046 | 0.82 | ALDH1A1 (0.61) | ALDH1A1HPGDNPC1RAB9ASIGMAR1 | |
| SCHEMBL2002382 | 0.80 | GAA (0.50) | ALDH1A1SIGMAR1GAAGRIN2DGRIN3B | |
| SCHEMBL1922317 | 0.80 | L3MBTL1 (0.55) | ALDH1A1HPGDNPC1RAB9ASIGMAR1 | |
| SCHEMBL10824116 | 0.79 | GRIN2D (0.44) | ALDH1A1HPGDSIGMAR1GAAGRIN2D | |
| SCHEMBL24728413 | 0.79 | ALDH1A1 (0.52) | ALDH1A1HPGDNPC1RAB9ASIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6191273-B1 | 3,6,10,14-SUBSTITUTED-3,6,10,16-TETRAAZABICYCLO(10.3.1)-HEXADE CA-1(16),12,14-TRIENE COMPOUNDS OF GIVEN FORMULA; ANTIBACTERIAL AND OTHER UTILITIES, SUCH AS TO SCREEN FOR PESTICIDES OR DRUGS | ISIS PHARMACEUTICALS, INC. | 2001-02-20 | — | — | US | disclosed |
| WO-1999011612-A2 | SUBSTITUTED CYCLIC COMPOUNDS AND MIXTURES COMPRISING SAME | ISIS PHARMACEUTICALS, INC. (US) | 1999-03-11 | — | — | WO | disclosed |