Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | PREP | P48147 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8262931 | 0.80 | SLC6A2 (0.49) | HSD17B10CYP1A2POLBMAPK1TSHR | |
| SCHEMBL8262946 | 0.77 | TDP1 (0.46) | ALDH1A1CYP1A2POLBMAPK1TSHR | |
| SCHEMBL4098389 | 0.75 | HTR2C (0.54) | ALDH1A1HSD17B10CYP1A2 | |
| Hydrochloric Acid SCHEMBL3337152 | 0.74 | HTR2C (0.55) | ALDH1A1HSD17B10CYP1A2 | |
| SCHEMBL8262944 | 0.74 | DRD2 (0.42) | ALDH1A1HSD17B10CYP1A2POLBTSHR | |
| SCHEMBL13613477 | 0.74 | CDK1 (0.40) | ALDH1A1 | |
| SCHEMBL13613444 | 0.74 | CDK1 (0.40) | ALDH1A1 | |
| SCHEMBL13613443 | 0.74 | CDK1 (0.40) | ALDH1A1 | |
| SCHEMBL5508963 | 0.73 | DRD2 (0.42) | ALDH1A1HSD17B10CYP1A2TSHR | |
| SCHEMBL2916758 | 0.73 | KCNA5 (0.49) | ALDH1A1HSD17B10CYP1A2POLBDPP4 |
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-7622585-B2 | Phenylglycinamide derivatives useful as anticoagulants | BRISTOL-MYERS SQUIBB COMPANY (US) | 2009-11-24 | — | — | US | disclosed |