Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.65 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.65 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.64 |
| ▸ | NPC1 | O15118 | 9/20 | 0.53 |
| ▸ | RAB9A | P51151 | 9/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.53 |
| ▸ | HPGD | P15428 | 6/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | GLA | P06280 | 5/20 | 0.49 |
| ▸ | KLK7 | P49862 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 4/20 | 0.47 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.47 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3172696 | 0.88 | PIK3CD (0.67) | PIK3CDPIK3CBALKNPC1RAB9A | |
| SCHEMBL16312867 | 0.85 | PIK3CD (0.65) | PIK3CDPIK3CBALKNPC1RAB9A | |
| SCHEMBL2623784 | 0.82 | PIK3CD (0.74) | PIK3CDPIK3CBALKNPC1RAB9A | |
| SCHEMBL15065996 | 0.81 | PIK3CD (0.67) | PIK3CDPIK3CBALKNPC1RAB9A | |
| SCHEMBL15086366 | 0.81 | PIK3CD (0.70) | PIK3CDPIK3CBALKNPC1RAB9A | |
| SCHEMBL7898123 | 0.81 | PIK3CD (0.66) | PIK3CDPIK3CBALKNPC1SMN1; SMN2 | |
| SCHEMBL592242 | 0.81 | PIK3CD (0.60) | PIK3CDPIK3CBALKNPC1RAB9A | |
| SCHEMBL20445761 | 0.80 | PIK3CD (0.62) | PIK3CDPIK3CBALKNPC1RAB9A | |
| SCHEMBL30674288 | 0.80 | PIK3CD (0.71) | PIK3CDPIK3CBALKNPC1RAB9A | |
| SCHEMBL4586333 | 0.80 | PIK3CD (0.74) | PIK3CDPIK3CBALKNPC1RAB9A |
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-2019117812-A1 | NEAR INFRA-RED MOLECULAR PROBES FOR USE IN DIAGNOSIS OF FIBROTIC CONDITIONS AND SCREENING OF ANTI-FIBROTIC DRUGS | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2019-06-20 | — | — | WO | disclosed |