Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.38 |
| ▸ | RAB9A | P51151 | 6/20 | 0.37 |
| ▸ | NPC1 | O15118 | 6/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL18644683 | 0.83 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2RAB9ANPC1MAPT | |
| SCHEMBL18644693 | 0.83 | ALDH1A1 (0.40) | ALDH1A1RAB9ANPC1MAPTHPGD | |
| SCHEMBL13165457 | 0.82 | RXFP1 (0.49) | ALDH1A1SMN1; SMN2RAB9ANPC1MAPT | |
| SCHEMBL27829742 | 0.79 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2RAB9ANPC1MAPT | |
| SCHEMBL27848208 | 0.71 | ALDH1A1 (0.60) | ALDH1A1RAB9ANPC1MAPTCYP1A2 | |
| SCHEMBL569821 | 0.71 | NOS1 (0.41) | ALDH1A1SMN1; SMN2RAB9ANPC1MAPT | |
| SCHEMBL18355569 | 0.70 | SMN1; SMN2 (0.37) | ALDH1A1SMN1; SMN2RAB9ANPC1MAPT | |
| SCHEMBL3000943 | 0.69 | SMN1; SMN2 (0.45) | ALDH1A1SMN1; SMN2RAB9ANPC1MAPT | |
| SCHEMBL18644689 | 0.69 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2RAB9ANPC1MAPT | |
| SCHEMBL3655946 | 0.66 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2RAB9ANPC1MAPT |
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-9617279-B1 | Imidazooxadiazole compounds | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-04-11 | — | — | US | disclosed |
| US-9598419-B1 | Imidazotriazine and imidazodiazine compounds | UNIVERSITE DE MONTREAL (CA) | 2017-03-21 | — | — | US | disclosed |