Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 1/20 | 0.43 |
| ▸ | PARP10 | Q53GL7 | 10/20 | 0.39 |
| ▸ | PARP4 | Q9UKK3 | 2/20 | 0.39 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.39 |
| ▸ | PARP16 | Q8N5Y8 | 1/20 | 0.39 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13978355 | 0.83 | PARP10 (0.41) | NOS1PARP10PARP4PARP15ALDH1A1 | |
| SCHEMBL13978226 | 0.81 | KMT2A (0.45) | KMT2APARP1TSHRPOLBCYP3A4 | |
| SCHEMBL13978356 | 0.80 | PARP10 (0.38) | NOS1PARP10PARP4PARP15ALDH1A1 | |
| SCHEMBL13977937 | 0.78 | NPC1 (0.39) | KMT2APOLBMAPTTDP1LMNA | |
| Terephthalamide SCHEMBL11512422 | 0.72 | PARP1 (0.67) | NOS1PARP10PARP4PARP15ALDH1A1 | |
| Terephthalamide SCHEMBL1087289 | 0.72 | PARP1 (0.67) | NOS1PARP10PARP4PARP15ALDH1A1 | |
| SCHEMBL2124392 | 0.71 | PARP10 (0.48) | NOS1PARP10PARP4PARP15ALDH1A1 | |
| Terephthalamide SCHEMBL538997 | 0.70 | PARP1 (0.63) | NOS1PARP10PARP4PARP15ALDH1A1 | |
| Terephthalamide SCHEMBL15168441 | 0.70 | PARP1 (0.63) | NOS1PARP10PARP4PARP15ALDH1A1 | |
| Terephthalamide SCHEMBL23774 | 0.69 | PARP1 (0.71) | NOS1PARP10PARP4PARP15ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012156920-A1 | BIO-ORTHOGONAL DRUG ACTIVATION | KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) | 2012-11-22 | — | — | WO | disclosed |