Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 4/20 | 0.35 |
| ▸ | ESR1 | P03372 | 3/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 3/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8480296 | 0.82 | TAAR1 (0.42) | KIF11ESR1ESR2 | |
| SCHEMBL8477968 | 0.80 | ALDH1A1 (0.38) | TSHRNPC1MAPTRAB9AIDO1 | |
| SCHEMBL8474675 | 0.79 | EBP (0.43) | TSHRKIF11ESR1ESR2NPC1 | |
| SCHEMBL20560176 | 0.77 | ESR1 (0.50) | TSHRKIF11ESR1ESR2ACHE | |
| SCHEMBL8480430 | 0.75 | CYP19A1 (0.38) | MAPTCA2 | |
| SCHEMBL23005 | 0.72 | ESR1 (0.52) | ESR1ESR2 | |
| SCHEMBL28040853 | 0.70 | ESR1 (0.50) | ESR1ESR2 | |
| SCHEMBL3533774 | 0.70 | IDO1 (0.44) | TSHRESR1ESR2ACHEIDO1 | |
| SCHEMBL3678427 | 0.70 | CYP1A2 (0.52) | MAPTACHEIDO1TDP1 | |
| SCHEMBL22941937 | 0.69 | ESR1 (0.50) | TSHRESR1ESR2MAPTACHE |
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-6004988-A | Carboxylic acid derivatives, their preparation and their use | BASF AKTIENGESELLSCHAFT (DE) | 1999-12-21 | — | — | US | disclosed |