Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | STAT1 | P42224 | 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 | |
|---|---|---|---|---|
| SCHEMBL9757047 | 0.90 | ALOX5 (0.42) | ALDH1A1AGPAT2MAOBNPC1RAB9A | |
| SCHEMBL9757055 | 0.76 | DPP4 (0.43) | ALDH1A1TSHRKDM4ETP53 | |
| SCHEMBL9757131 | 0.76 | MAOB (0.42) | ALDH1A1ESR1TDP1SMN1; SMN2KDM4E | |
| SCHEMBL28667845 | 0.71 | TP53 (0.61) | ALDH1A1TDP1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL19636606 | 0.71 | ALDH1A1 (0.50) | POLBALDH1A1ESR1CHRM1TSHR | |
| SCHEMBL9635486 | 0.71 | MAOB (0.58) | ALDH1A1ESR1CHRM1TSHRSLC6A2 | |
| SCHEMBL11197714 | 0.67 | KMT2A (0.51) | POLBALDH1A1ESR1TSHRLMNA | |
| SCHEMBL6233680 | 0.66 | ESR1 (0.47) | POLBALDH1A1ESR1CHRM1TSHR | |
| SCHEMBL24986639 | 0.65 | S1PR4 (0.47) | ALDH1A1ESR1CHRM1TSHRSLC6A2 | |
| SCHEMBL7538753 | 0.65 | GAA (0.34) | POLBTDP1KDM4EAGPAT2TP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991019475-A2 | QUINOLINYL-BENZOHETEROBICYCLIC DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D¿4? | RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) | 1991-12-26 | — | — | WO | disclosed |
| US-5041453-A | Quinolinyl-benzoheterobicyclic derivatives as antagonists of leukotriene D4 | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1991-08-20 | — | — | US | disclosed |