Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | UPP1 | Q16831 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.38 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | NSD2 | O96028 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.37 |
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL474019 | 0.81 | TPMT (0.48) | TSHRUPP1KDM4ETDP1ALDH1A1 | |
| SCHEMBL17664048 | 0.75 | TRPV4 (0.48) | PARP1PARP15PARP10PARP2S1PR2 | |
| SCHEMBL18471225 | 0.75 | SMN1; SMN2 (0.49) | TSHRPARP1TDP1ALDH1A1RECQL | |
| SCHEMBL10831613 | 0.75 | PARP1 (0.46) | TSHRPARP1TDP1RECQLHSD17B10 | |
| SCHEMBL2767509 | 0.75 | S1PR3 (0.50) | PARP1PARP15PARP10PARP2S1PR2 | |
| SCHEMBL26089966 | 0.75 | MEN1 (0.42) | TSHRUPP1KDM4ETDP1ALDH1A1 | |
| SCHEMBL6137034 | 0.73 | CA12 (0.55) | KDM4EALDH1A1LMNAHSD17B10MAPT | |
| SCHEMBL1004660 | 0.73 | PARP1 (0.50) | TSHRKDM4EPARP1TDP1ALDH1A1 | |
| SCHEMBL3220166 | 0.73 | CA1 (0.48) | TSHRKDM4EPARP1ALDH1A1LMNA | |
| SCHEMBL1397262 | 0.73 | POLB (0.50) | TSHRPARP1TDP1RECQLLMNA |
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-2016053855-A1 | SPHINGOSINE-1-PHOSPATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2016-04-07 | — | — | WO | disclosed |