Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 2/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.36 |
| ▸ | MMP13 | P45452 | 5/20 | 0.35 |
| ▸ | MMP2 | P08253 | 3/20 | 0.35 |
| ▸ | MMP8 | P22894 | 3/20 | 0.35 |
| ▸ | MMP12 | P39900 | 3/20 | 0.35 |
| ▸ | MMP14 | P50281 | 3/20 | 0.35 |
| ▸ | MMP16 | P51512 | 3/20 | 0.35 |
| ▸ | MMP9 | P14780 | 3/20 | 0.34 |
| ▸ | MMP1 | P03956 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | VDR | P11473 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | NR1I3 | Q14994 | 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 | |
|---|---|---|---|---|
| SCHEMBL23287266 | 0.75 | MBOAT4 (0.45) | TRPV1KDM4EPDCD1LG2CD274 | |
| SCHEMBL10233300 | 0.73 | CD274 (0.48) | TRPV1KDM4ESMN1; SMN2PDCD1LG2CD274 | |
| SCHEMBL25530596 | 0.73 | TRPV1 (0.38) | TRPV1ALDH1A1SMN1; SMN2PDCD1LG2CD274 | |
| Anisole SCHEMBL28312620 | 0.72 | CFTR (0.40) | CA4LTA4HMAPTNPSR1 | |
| Hydrochloric Acid SCHEMBL620018 | 0.72 | CD274 (0.47) | TRPV1KDM4ESMN1; SMN2PDCD1LG2CD274 | |
| SCHEMBL12427065 | 0.71 | HPGD (0.49) | MAPTL3MBTL1TDP1KDM4EALDH1A1 | |
| SCHEMBL14845777 | 0.71 | TRPV1 (0.43) | TRPV1SMN1; SMN2PDCD1LG2CD274 | |
| SCHEMBL15128430 | 0.70 | PDCD1LG2 (0.43) | TRPV1SMN1; SMN2PDCD1LG2CD274 | |
| SCHEMBL2029639 | 0.68 | APOBEC3A (0.44) | MAPTKDM4EALDH1A1LMNASMN1; SMN2 | |
| Anisole SCHEMBL27438049 | 0.66 | CA4 (0.74) | CA4LTA4HNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-110035993-A | SUBSTITUTED PYRROLIDINES AS CFTR MODULATORS | 艾伯维公司 | 2019-07-19 | — | — | CN | disclosed |