Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.64 |
| ▸ | MAPT | P10636 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | RECQL | P46063 | 1/20 | 0.64 |
| ▸ | BLM | P54132 | 1/20 | 0.64 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.64 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | CES2 | O00748 | 2/20 | 0.60 |
| ▸ | CES1 | P23141 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | PARP10 | Q53GL7 | 4/20 | 0.56 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Terephthalamide SCHEMBL17907469 | 0.95 | ALDH1A1 (0.62) | PARP1TDP1POLBCYP3A4MAPT | |
| SCHEMBL76475 | 0.95 | ALDH1A1 (0.62) | PARP1TDP1POLBCYP3A4MAPT | |
| Acetic Acid SCHEMBL27845273 | 0.93 | ALDH1A1 (0.58) | PARP1TDP1POLBCYP3A4MAPT | |
| SCHEMBL10416433 | 0.92 | ALDH1A1 (0.59) | PARP1TDP1POLBCYP3A4MAPT | |
| Hydrochloric Acid SCHEMBL4376615 | 0.92 | ALDH1A1 (0.59) | PARP1TDP1POLBCYP3A4MAPT | |
| SCHEMBL30775329 | 0.92 | ALDH1A1 (0.59) | PARP1TDP1POLBCYP3A4MAPT | |
| Hydrazine SCHEMBL28484381 | 0.92 | ALDH1A1 (0.59) | PARP1TDP1POLBCYP3A4MAPT | |
| Hydrochloric Acid SCHEMBL1776305 | 0.92 | ALDH1A1 (0.59) | PARP1TDP1POLBCYP3A4MAPT | |
| Terephthalic Acid SCHEMBL16616816 | 0.91 | ALDH1A1 (0.77) | PARP1TDP1POLBCYP3A4MAPT | |
| Hydrochloric Acid SCHEMBL4879563 | 0.90 | ALDH1A1 (0.56) | PARP1TDP1POLBCYP3A4MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-107082779-A | It is used as the noval chemical compound of C MET protein kinase modulators | 理森制药股份公司 | 2017-08-22 | — | — | CN | claimed |
| CN-107082779-A | It is used as the noval chemical compound of C MET protein kinase modulators | 理森制药股份公司 | 2017-08-22 | — | — | CN | disclosed |