Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SETDB1 | Q15047 | 1/20 | 0.50 |
| ▸ | MTNR1A | P48039 | 5/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.43 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| SCHEMBL14204990 | 0.84 | SETDB1 (0.59) | SETDB1MTNR1ANPSR1MTNR1BNQO2 | |
| SCHEMBL15331613 | 0.82 | NPC1 (0.47) | MTNR1ALIPGNPC1RAB9AHPGD | |
| SCHEMBL2560666 | 0.81 | NPC1 (0.50) | LIPGNPC1RAB9AHPGDALDH1A1 | |
| SCHEMBL16634646 | 0.80 | TGM2 (0.45) | LIPGNPC1RAB9AHPGDALDH1A1 | |
| SCHEMBL15030741 | 0.79 | SETDB1 (0.51) | SETDB1MTNR1ANPSR1MTNR1BNQO2 | |
| SCHEMBL14651452 | 0.79 | SETDB1 (0.54) | SETDB1MTNR1ANPSR1MTNR1BNQO2 | |
| SCHEMBL3490988 | 0.77 | KCNA5 (0.53) | NQO2 | |
| SCHEMBL29473217 | 0.77 | KCNA5 (0.53) | NQO2 | |
| SCHEMBL885156 | 0.77 | ALDH1A1 (0.66) | SETDB1NPC1RAB9AHPGDALDH1A1 | |
| SCHEMBL4362706 | 0.77 | TSHR (0.57) | SETDB1MTNR1ANPSR1ALDH1A1KMT2A |
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-2686308-A2 | ANTIMICROBIAL AGENTS | Rib-X Pharmaceuticals, Inc. (US) | 2014-01-22 | — | — | EP | disclosed |
| WO-2012125832-A2 | ANTIMICROBIAL AGENTS | RIB-X PHARMACEUTICALS, INC. (US) | 2012-09-20 | — | — | WO | disclosed |