Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A3 | P43003 | 1/20 | 0.46 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.46 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL16140111 | 0.79 | SLC1A3 (0.50) | SLC1A3SLC1A2SLC1A1TDP1GABRR1 | |
| SCHEMBL4610258 | 0.79 | — | — | |
| SCHEMBL967949 | 0.77 | CHRM1 (0.52) | SLC1A3SLC1A2SLC1A1TDP1TSHR | |
| SCHEMBL1572883 | 0.77 | SLC1A3 (0.48) | SLC1A3SLC1A2SLC1A1TDP1GABRR1 | |
| SCHEMBL5514417 | 0.77 | SLC1A3 (0.48) | SLC1A3SLC1A2SLC1A1TDP1GABRR1 | |
| SCHEMBL31544399 | 0.77 | SLC1A3 (0.48) | SLC1A3SLC1A2SLC1A1TDP1GABRR1 | |
| SCHEMBL31544402 | 0.77 | SLC1A3 (0.48) | SLC1A3SLC1A2SLC1A1TDP1GABRR1 | |
| SCHEMBL3651519 | 0.77 | CHRM1 (0.52) | SLC1A3SLC1A2SLC1A1TDP1TSHR | |
| SCHEMBL21052495 | 0.77 | GABRR1 (0.54) | SLC1A3SLC1A2SLC1A1TDP1GABRR1 | |
| SCHEMBL188173 | 0.77 | SLC1A3 (0.48) | SLC1A3SLC1A2SLC1A1TDP1GABRR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1183107-C | Alkynyl containing hydroxamic acid compounds as TACE inhibitors | ���Ͽع�����˾ | 2005-01-05 | — | — | CN | disclosed |
| CN-1337945-A | Alkynyl containing hydroxamic acid compounds as TACE inhibitors | AMERICAN CYANAMID CO (US) | 2002-02-27 | — | — | CN | disclosed |
| CN-1283183-A | Hydroxamic and carboxylic acid derivatives having MMP and TNF inhibitory activity | DARWIN DISCOVERY LTD (GB) | 2001-02-07 | — | — | CN | disclosed |
| CN-1227540-A | Hydroxamic and carboxylic acid derivatives having MMP and TNF inhibitory activity | DARWIN DISCOVERY CO LTD (GB) | 1999-09-01 | — | — | CN | disclosed |