Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKDC | P78527 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.34 |
| ▸ | F2RL3 | Q96RI0 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.33 |
| ▸ | CSF1R | P07333 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14347475 | 0.85 | HTR1B (0.49) | PRKDCKDM4EALDH1A1LMNACSF1R | |
| SCHEMBL14347495 | 0.84 | MAOA (0.49) | PRKDCMAOAKDM4ENPC1ALDH1A1 | |
| SCHEMBL14347527 | 0.82 | LOXL2 (0.43) | PRKDCLOXL2 | |
| SCHEMBL14347532 | 0.82 | CYP1A2 (0.50) | PRKDCKDM4EALDH1A1 | |
| SCHEMBL14374658 | 0.81 | PRKDC (0.39) | PRKDCKDM1ACNR2MAOAKDM4E | |
| SCHEMBL14347473 | 0.81 | PRKDC (0.59) | PRKDCCNR2KDM4ESIGMAR1 | |
| SCHEMBL14347474 | 0.80 | PRKDC (0.48) | PRKDCSIGMAR1 | |
| SCHEMBL14347531 | 0.75 | MAOA (0.33) | PRKDCMAOAKDM4ENPC1ALDH1A1 | |
| SCHEMBL14347543 | 0.73 | TNKS (0.39) | NPC1ALDH1A1RAB9A | |
| SCHEMBL14347461 | 0.72 | APP (0.45) | KDM4ENPC1ALDH1A1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-7312211-B2 | Pryanone compounds useful as reversible inhibitors of cysteine proteases | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. | 2007-12-25 | — | — | US | disclosed |