Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | DDX3X | O00571 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL24653597 | 0.80 | HPGD (0.53) | NPC1RAB9AHPGDPOLBALDH1A1 | |
| SCHEMBL18361302 | 0.75 | NPC1 (0.62) | NPC1RAB9AHPGDPOLBALDH1A1 | |
| SCHEMBL20333639 | 0.75 | EPHX1 (0.47) | NPC1RAB9AHPGDPOLBALDH1A1 | |
| SCHEMBL20035718 | 0.73 | NPC1 (0.55) | NPC1RAB9AHPGDPOLBALDH1A1 | |
| SCHEMBL24611544 | 0.72 | HPGD (0.49) | NPC1RAB9AHPGDPOLBALDH1A1 | |
| SCHEMBL19393314 | 0.72 | NPC1 (0.42) | NPC1RAB9AHPGDPOLBALDH1A1 | |
| SCHEMBL21290344 | 0.71 | NPC1 (0.48) | NPC1RAB9AHPGDPOLBALDH1A1 | |
| SCHEMBL11310301 | 0.71 | NPC1 (0.57) | NPC1RAB9AHPGDPOLBALDH1A1 | |
| SCHEMBL5932499 | 0.71 | RAB9A (0.69) | NPC1RAB9AHPGDPOLBALDH1A1 | |
| SCHEMBL648951 | 0.70 | NPC1 (0.62) | NPC1RAB9AHPGDPOLBALDH1A1 |
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-2017064675-A1 | HINDERED DISULFIDE DRUG CONJUGATES | GENENTECH, INC. (US) | 2017-04-20 | — | — | WO | disclosed |