Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 2/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.50 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.50 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.50 |
| ▸ | PTGER2 | P43116 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP3 | P08254 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP12 | P39900 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL538512 | 0.92 | KMT2A (0.60) | AKR1B1PTGS1KMT2APTGER1PTGER4 | |
| SCHEMBL27701716 | 0.90 | KMT2A (0.58) | AKR1B1PTGS1KMT2APTGER1PTGER4 | |
| Biphenyl SCHEMBL11146899 | 0.90 | AKR1B1 (0.57) | AKR1B1PTGS1KMT2APTGER1PTGER4 | |
| SCHEMBL28594606 | 0.90 | KMT2A (0.58) | AKR1B1PTGS1KMT2APTGER1PTGER4 | |
| SCHEMBL29512995 | 0.90 | KMT2A (0.58) | AKR1B1PTGS1KMT2APTGER1PTGER4 | |
| Ammonia Solution, Strong SCHEMBL27926479 | 0.90 | KMT2A (0.58) | AKR1B1PTGS1KMT2APTGER1PTGER4 | |
| Hydrochloric Acid SCHEMBL11895689 | 0.90 | KMT2A (0.58) | AKR1B1PTGS1KMT2APTGER1PTGER4 | |
| SCHEMBL7827157 | 0.89 | AKR1B1 (0.67) | AKR1B1PTGS1PTGER1PTGER4PTGER3 | |
| Ethane SCHEMBL28588588 | 0.88 | PTGS1 (0.57) | AKR1B1PTGS1KMT2APTGER1PTGER4 | |
| SCHEMBL5961842 | 0.88 | PTGS1 (0.59) | AKR1B1PTGS1KMT2APTGER1PTGER4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1754748-B1 | Fragrance-emitting rubber composition for tire | KUMHO TIRE CO INC (KR) | 2010-09-29 | — | — | EP | claimed |
| EP-0164763-B1 | SUBSTITUTED TETRALINS AND INDANES (I), USE OF (I) AS PERFUMING AND/OR FLAVOURING AGENTS, AND PERFUMED AND/OR FLAVOURED COMPOSITIONS CONTAINING (I) | L. Givaudan & Cie Société Anonyme (CH) | 1987-06-16 | — | — | EP | disclosed |